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

Systemtic Name: N-(2,4-dimethoxyphenyl)-5-(8-methoxy-4-oxidanylidene-2-sulfanylidene-1,5-dihydropyrimido[5,4-b]indol-3-yl)pentanamide Openeye Name: N-(2,4-dimethoxyphenyl)-5-(8-methoxy-4-oxo-2-thioxo-1,5-dihydropyrimido[5,4-b]indol-3-yl)pentanamide CAS Name: N-(2,4-dimethoxyphenyl)-5-(8-methoxy-4-oxo-2-sulfanylidene-1,5-dihydropyrimido[5,4-b]indol-3-yl)pentanamide IUPAC Name: N-(2,4-dimethoxyphenyl)-5-(8-methoxy-4-oxo-2-sulfanylidene-1,5-dihydropyrimido[5,4-b]indol-3-yl)pentanamide Traditional Name: N-(2,4-dimethoxyphenyl)-5-(4-keto-8-methoxy-2-thioxo-1,5-dihydropyrimid[5,4-b]indol-3-yl)valeramide Formula: C24H26N4O5S MolecularWeight: 482.55204

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC3=C2NC(=S)N(C3=O)CCCCC(=O)NC4=C(C=C(C=C4)OC)OC

Isomeric SMILES

COC1=CC2=C(C=C1)NC3=C2NC(=S)N(C3=O)CCCCC(=O)NC4=C(C=C(C=C4)OC)OC

InChI

InChI=1S/C24H26N4O5S/c1-31-14-7-9-17-16(12-14)21-22(26-17)23(30)28(24(34)27-21)11-5-4-6-20(29)25-18-10-8-15(32-2)13-19(18)33-3/h7-10,12-13,26H,4-6,11H2,1-3H3,(H,25,29)(H,27,34)