N-cyclopentyl-3-(4-methoxyphenyl)-2-[(4-methylphenyl)methylsulfanyl]-4-oxidanylidene-quinazoline-7-carboxamide

Systemtic Name: N-cyclopentyl-3-(4-methoxyphenyl)-2-[(4-methylphenyl)methylsulfanyl]-4-oxidanylidene-quinazoline-7-carboxamide Openeye Name: N-cyclopentyl-3-(4-methoxyphenyl)-4-oxo-2-(p-tolylmethylsulfanyl)quinazoline-7-carboxamide CAS Name: N-cyclopentyl-3-(4-methoxyphenyl)-2-[(4-methylphenyl)methylthio]-4-oxo-7-quinazolinecarboxamide IUPAC Name: N-cyclopentyl-3-(4-methoxyphenyl)-2-[(4-methylphenyl)methylsulfanyl]-4-oxoquinazoline-7-carboxamide Traditional Name: N-cyclopentyl-4-keto-3-(4-methoxyphenyl)-2-[(4-methylbenzyl)thio]quinazoline-7-carboxamide Formula: C29H29N3O3S MolecularWeight: 499.62386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NC3=C(C=CC(=C3)C(=O)NC4CCCC4)C(=O)N2C5=CC=C(C=C5)OC

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC3=C(C=CC(=C3)C(=O)NC4CCCC4)C(=O)N2C5=CC=C(C=C5)OC

InChI

InChI=1S/C29H29N3O3S/c1-19-7-9-20(10-8-19)18-36-29-31-26-17-21(27(33)30-22-5-3-4-6-22)11-16-25(26)28(34)32(29)23-12-14-24(35-2)15-13-23/h7-17,22H,3-6,18H2,1-2H3,(H,30,33)