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

Systemtic Name: N-cyclohexyl-5-(8-methoxy-4-oxidanylidene-2-sulfanylidene-1,5-dihydropyrimido[5,4-b]indol-3-yl)-N-methyl-pentanamide Openeye Name: N-cyclohexyl-5-(8-methoxy-4-oxo-2-thioxo-1,5-dihydropyrimido[5,4-b]indol-3-yl)-N-methyl-pentanamide CAS Name: N-cyclohexyl-5-(8-methoxy-4-oxo-2-sulfanylidene-1,5-dihydropyrimido[5,4-b]indol-3-yl)-N-methylpentanamide IUPAC Name: N-cyclohexyl-5-(8-methoxy-4-oxo-2-sulfanylidene-1,5-dihydropyrimido[5,4-b]indol-3-yl)-N-methylpentanamide Traditional Name: N-cyclohexyl-5-(4-keto-8-methoxy-2-thioxo-1,5-dihydropyrimid[5,4-b]indol-3-yl)-N-methyl-valeramide Formula: C23H30N4O3S MolecularWeight: 442.5743

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C(=O)CCCCN2C(=O)C3=C(C4=C(N3)C=CC(=C4)OC)NC2=S

Isomeric SMILES

CN(C1CCCCC1)C(=O)CCCCN2C(=O)C3=C(C4=C(N3)C=CC(=C4)OC)NC2=S

InChI

InChI=1S/C23H30N4O3S/c1-26(15-8-4-3-5-9-15)19(28)10-6-7-13-27-22(29)21-20(25-23(27)31)17-14-16(30-2)11-12-18(17)24-21/h11-12,14-15,24H,3-10,13H2,1-2H3,(H,25,31)