N-(4-cyclopentyloxyphenyl)-3-methyl-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-(4-cyclopentyloxyphenyl)-3-methyl-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-[4-(cyclopentoxy)phenyl]-3-methyl-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-(4-cyclopentyloxyphenyl)-3-methyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-(4-cyclopentyloxyphenyl)-3-methyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-[4-(cyclopentoxy)phenyl]-4-keto-3-methyl-2-thioxo-1H-quinazoline-7-carboxamide Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)OC4CCCC4)NC1=S

Isomeric SMILES

CN1C(=O)C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)OC4CCCC4)NC1=S

InChI

InChI=1S/C21H21N3O3S/c1-24-20(26)17-11-6-13(12-18(17)23-21(24)28)19(25)22-14-7-9-16(10-8-14)27-15-4-2-3-5-15/h6-12,15H,2-5H2,1H3,(H,22,25)(H,23,28)