N-cyclohexyl-4-(8-methoxy-4-oxidanylidene-2-sulfanylidene-1,5-dihydropyrimido[5,4-b]indol-3-yl)-N-methyl-butanamide

Systemtic Name: N-cyclohexyl-4-(8-methoxy-4-oxidanylidene-2-sulfanylidene-1,5-dihydropyrimido[5,4-b]indol-3-yl)-N-methyl-butanamide Openeye Name: N-cyclohexyl-4-(8-methoxy-4-oxo-2-thioxo-1,5-dihydropyrimido[5,4-b]indol-3-yl)-N-methyl-butanamide CAS Name: N-cyclohexyl-4-(8-methoxy-4-oxo-2-sulfanylidene-1,5-dihydropyrimido[5,4-b]indol-3-yl)-N-methylbutanamide IUPAC Name: N-cyclohexyl-4-(8-methoxy-4-oxo-2-sulfanylidene-1,5-dihydropyrimido[5,4-b]indol-3-yl)-N-methylbutanamide Traditional Name: N-cyclohexyl-4-(4-keto-8-methoxy-2-thioxo-1,5-dihydropyrimid[5,4-b]indol-3-yl)-N-methyl-butyramide Formula: C22H28N4O3S MolecularWeight: 428.54772

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C(=O)CCCN2C(=O)C3=C(C4=C(N3)C=CC(=C4)OC)NC2=S

Isomeric SMILES

CN(C1CCCCC1)C(=O)CCCN2C(=O)C3=C(C4=C(N3)C=CC(=C4)OC)NC2=S

InChI

InChI=1S/C22H28N4O3S/c1-25(14-7-4-3-5-8-14)18(27)9-6-12-26-21(28)20-19(24-22(26)30)16-13-15(29-2)10-11-17(16)23-20/h10-11,13-14,23H,3-9,12H2,1-2H3,(H,24,30)