4-oxidanylidene-3-pentyl-2-phenacylsulfanyl-N-(phenylmethyl)quinazoline-7-carboxamide

Systemtic Name: 4-oxidanylidene-3-pentyl-2-phenacylsulfanyl-N-(phenylmethyl)quinazoline-7-carboxamide Openeye Name: N-benzyl-4-oxo-3-pentyl-2-phenacylsulfanyl-quinazoline-7-carboxamide CAS Name: 4-oxo-3-pentyl-2-(phenacylthio)-N-(phenylmethyl)-7-quinazolinecarboxamide IUPAC Name: N-benzyl-4-oxo-3-pentyl-2-phenacylsulfanylquinazoline-7-carboxamide Traditional Name: 3-amyl-N-benzyl-4-keto-2-(phenacylthio)quinazoline-7-carboxamide Formula: C29H29N3O3S MolecularWeight: 499.62386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3=CC=CC=C3)N=C1SCC(=O)C4=CC=CC=C4

Isomeric SMILES

CCCCCN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3=CC=CC=C3)N=C1SCC(=O)C4=CC=CC=C4

InChI

InChI=1S/C29H29N3O3S/c1-2-3-10-17-32-28(35)24-16-15-23(27(34)30-19-21-11-6-4-7-12-21)18-25(24)31-29(32)36-20-26(33)22-13-8-5-9-14-22/h4-9,11-16,18H,2-3,10,17,19-20H2,1H3,(H,30,34)