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

Systemtic Name: 4-(8-methoxy-4-oxidanylidene-2-sulfanylidene-1,5-dihydropyrimido[5,4-b]indol-3-yl)-N-[(3-methoxyphenyl)methyl]butanamide Openeye Name: 4-(8-methoxy-4-oxo-2-thioxo-1,5-dihydropyrimido[5,4-b]indol-3-yl)-N-[(3-methoxyphenyl)methyl]butanamide CAS Name: 4-(8-methoxy-4-oxo-2-sulfanylidene-1,5-dihydropyrimido[5,4-b]indol-3-yl)-N-[(3-methoxyphenyl)methyl]butanamide IUPAC Name: 4-(8-methoxy-4-oxo-2-sulfanylidene-1,5-dihydropyrimido[5,4-b]indol-3-yl)-N-[(3-methoxyphenyl)methyl]butanamide Traditional Name: 4-(4-keto-8-methoxy-2-thioxo-1,5-dihydropyrimid[5,4-b]indol-3-yl)-N-m-anisyl-butyramide Formula: C23H24N4O4S MolecularWeight: 452.52606

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC3=C2NC(=S)N(C3=O)CCCC(=O)NCC4=CC(=CC=C4)OC

Isomeric SMILES

COC1=CC2=C(C=C1)NC3=C2NC(=S)N(C3=O)CCCC(=O)NCC4=CC(=CC=C4)OC

InChI

InChI=1S/C23H24N4O4S/c1-30-15-6-3-5-14(11-15)13-24-19(28)7-4-10-27-22(29)21-20(26-23(27)32)17-12-16(31-2)8-9-18(17)25-21/h3,5-6,8-9,11-12,25H,4,7,10,13H2,1-2H3,(H,24,28)(H,26,32)