6-(8-methoxy-4-oxidanylidene-2-sulfanylidene-1,5-dihydropyrimido[5,4-b]indol-3-yl)-N-[(2-methoxyphenyl)methyl]hexanamide

Systemtic Name: 6-(8-methoxy-4-oxidanylidene-2-sulfanylidene-1,5-dihydropyrimido[5,4-b]indol-3-yl)-N-[(2-methoxyphenyl)methyl]hexanamide Openeye Name: 6-(8-methoxy-4-oxo-2-thioxo-1,5-dihydropyrimido[5,4-b]indol-3-yl)-N-[(2-methoxyphenyl)methyl]hexanamide CAS Name: 6-(8-methoxy-4-oxo-2-sulfanylidene-1,5-dihydropyrimido[5,4-b]indol-3-yl)-N-[(2-methoxyphenyl)methyl]hexanamide IUPAC Name: 6-(8-methoxy-4-oxo-2-sulfanylidene-1,5-dihydropyrimido[5,4-b]indol-3-yl)-N-[(2-methoxyphenyl)methyl]hexanamide Traditional Name: 6-(4-keto-8-methoxy-2-thioxo-1,5-dihydropyrimid[5,4-b]indol-3-yl)-N-o-anisyl-hexanamide Formula: C25H28N4O4S MolecularWeight: 480.57922

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC3=C2NC(=S)N(C3=O)CCCCCC(=O)NCC4=CC=CC=C4OC

Isomeric SMILES

COC1=CC2=C(C=C1)NC3=C2NC(=S)N(C3=O)CCCCCC(=O)NCC4=CC=CC=C4OC

InChI

InChI=1S/C25H28N4O4S/c1-32-17-11-12-19-18(14-17)22-23(27-19)24(31)29(25(34)28-22)13-7-3-4-10-21(30)26-15-16-8-5-6-9-20(16)33-2/h5-6,8-9,11-12,14,27H,3-4,7,10,13,15H2,1-2H3,(H,26,30)(H,28,34)