N-cyclopentyl-3-(3,5-dimethoxyphenyl)-2-[(2,5-dimethylphenyl)methylsulfanyl]-4-oxidanylidene-quinazoline-7-carboxamide

Systemtic Name: N-cyclopentyl-3-(3,5-dimethoxyphenyl)-2-[(2,5-dimethylphenyl)methylsulfanyl]-4-oxidanylidene-quinazoline-7-carboxamide Openeye Name: N-cyclopentyl-3-(3,5-dimethoxyphenyl)-2-[(2,5-dimethylphenyl)methylsulfanyl]-4-oxo-quinazoline-7-carboxamide CAS Name: N-cyclopentyl-3-(3,5-dimethoxyphenyl)-2-[(2,5-dimethylphenyl)methylthio]-4-oxo-7-quinazolinecarboxamide IUPAC Name: N-cyclopentyl-3-(3,5-dimethoxyphenyl)-2-[(2,5-dimethylphenyl)methylsulfanyl]-4-oxoquinazoline-7-carboxamide Traditional Name: N-cyclopentyl-3-(3,5-dimethoxyphenyl)-2-[(2,5-dimethylbenzyl)thio]-4-keto-quinazoline-7-carboxamide Formula: C31H33N3O4S MolecularWeight: 543.67642

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H33N3O4S/c1-19-9-10-20(2)22(13-19)18-39-31-33-28-14-21(29(35)32-23-7-5-6-8-23)11-12-27(28)30(36)34(31)24-15-25(37-3)17-26(16-24)38-4/h9-17,23H,5-8,18H2,1-4H3,(H,32,35)