Geometry & MOs

Info

ID:	32843
PubChem CID:	7848878
Reduced:	SN3O5C20H21 (1)
Stoich.:	AB3C5D20E21 (1)
Weight, g/mol:	415.120192
ΔH_f, kcal/mol:	-150.21
Dipole, Da:	4.84
IP(EA), eV:	-9.26(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-(furan-2-ylmethyl)-4-oxo-2-[2-oxo-2-(propylamino)ethyl]sulfanylquinazoline-7-carboxylate

Drug info:

PubChemData

Smile

CC(C)NC(=O)CSC1=NC2=C(C=CC(=C2)C(=O)OC)C(=O)N1CC3=CC=CO3

DOS

IR

Vibrations