8-methoxy-3-(4-oxidanylidene-4-pyrrolidin-1-yl-butyl)-2-sulfanylidene-1,5-dihydropyrimido[5,4-b]indol-4-one

Systemtic Name: 8-methoxy-3-(4-oxidanylidene-4-pyrrolidin-1-yl-butyl)-2-sulfanylidene-1,5-dihydropyrimido[5,4-b]indol-4-one Openeye Name: 8-methoxy-3-(4-oxo-4-pyrrolidin-1-yl-butyl)-2-thioxo-1,5-dihydropyrimido[5,4-b]indol-4-one CAS Name: 8-methoxy-3-[4-oxo-4-(1-pyrrolidinyl)butyl]-2-sulfanylidene-1,5-dihydropyrimido[5,4-b]indol-4-one IUPAC Name: 8-methoxy-3-(4-oxo-4-pyrrolidin-1-ylbutyl)-2-sulfanylidene-1,5-dihydropyrimido[5,4-b]indol-4-one Traditional Name: 3-(4-keto-4-pyrrolidino-butyl)-8-methoxy-2-thioxo-1,5-dihydropyrimid[5,4-b]indol-4-one Formula: C19H22N4O3S MolecularWeight: 386.46798

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC3=C2NC(=S)N(C3=O)CCCC(=O)N4CCCC4

Isomeric SMILES

COC1=CC2=C(C=C1)NC3=C2NC(=S)N(C3=O)CCCC(=O)N4CCCC4

InChI

InChI=1S/C19H22N4O3S/c1-26-12-6-7-14-13(11-12)16-17(20-14)18(25)23(19(27)21-16)10-4-5-15(24)22-8-2-3-9-22/h6-7,11,20H,2-5,8-10H2,1H3,(H,21,27)