methyl 3-[(2-chlorophenyl)methyl]-4-oxidanylidene-2-[2-oxidanylidene-2-(pentan-2-ylamino)ethyl]sulfanyl-quinazoline-7-carboxylate

Systemtic Name: methyl 3-[(2-chlorophenyl)methyl]-4-oxidanylidene-2-[2-oxidanylidene-2-(pentan-2-ylamino)ethyl]sulfanyl-quinazoline-7-carboxylate Openeye Name: methyl 3-[(2-chlorophenyl)methyl]-2-[2-(1-methylbutylamino)-2-oxo-ethyl]sulfanyl-4-oxo-quinazoline-7-carboxylate CAS Name: 3-[(2-chlorophenyl)methyl]-4-oxo-2-[[2-oxo-2-(pentan-2-ylamino)ethyl]thio]-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 3-[(2-chlorophenyl)methyl]-4-oxo-2-[2-oxo-2-(pentan-2-ylamino)ethyl]sulfanylquinazoline-7-carboxylate Traditional Name: 3-(2-chlorobenzyl)-4-keto-2-[[2-keto-2-(1-methylbutylamino)ethyl]thio]quinazoline-7-carboxylic acid methyl ester Formula: C24H26ClN3O4S MolecularWeight: 487.99894

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)CSC1=NC2=C(C=CC(=C2)C(=O)OC)C(=O)N1CC3=CC=CC=C3Cl

Isomeric SMILES

CCCC(C)NC(=O)CSC1=NC2=C(C=CC(=C2)C(=O)OC)C(=O)N1CC3=CC=CC=C3Cl

InChI

InChI=1S/C24H26ClN3O4S/c1-4-7-15(2)26-21(29)14-33-24-27-20-12-16(23(31)32-3)10-11-18(20)22(30)28(24)13-17-8-5-6-9-19(17)25/h5-6,8-12,15H,4,7,13-14H2,1-3H3,(H,26,29)