N-cyclohexyl-5-(6,7-diethoxy-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)pentanamide

Systemtic Name: N-cyclohexyl-5-(6,7-diethoxy-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)pentanamide Openeye Name: N-cyclohexyl-5-(6,7-diethoxy-4-oxo-2-thioxo-1H-quinazolin-3-yl)pentanamide CAS Name: N-cyclohexyl-5-(6,7-diethoxy-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)pentanamide IUPAC Name: N-cyclohexyl-5-(6,7-diethoxy-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)pentanamide Traditional Name: N-cyclohexyl-5-(6,7-diethoxy-4-keto-2-thioxo-1H-quinazolin-3-yl)valeramide Formula: C23H33N3O4S MolecularWeight: 447.59082

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)C(=O)N(C(=S)N2)CCCCC(=O)NC3CCCCC3)OCC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C(=O)N(C(=S)N2)CCCCC(=O)NC3CCCCC3)OCC

InChI

InChI=1S/C23H33N3O4S/c1-3-29-19-14-17-18(15-20(19)30-4-2)25-23(31)26(22(17)28)13-9-8-12-21(27)24-16-10-6-5-7-11-16/h14-16H,3-13H2,1-2H3,(H,24,27)(H,25,31)