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

Systemtic Name: N-(2,2-dimethoxyethyl)-4-(8-methoxy-4-oxidanylidene-2-sulfanylidene-1,5-dihydropyrimido[5,4-b]indol-3-yl)butanamide Openeye Name: N-(2,2-dimethoxyethyl)-4-(8-methoxy-4-oxo-2-thioxo-1,5-dihydropyrimido[5,4-b]indol-3-yl)butanamide CAS Name: N-(2,2-dimethoxyethyl)-4-(8-methoxy-4-oxo-2-sulfanylidene-1,5-dihydropyrimido[5,4-b]indol-3-yl)butanamide IUPAC Name: N-(2,2-dimethoxyethyl)-4-(8-methoxy-4-oxo-2-sulfanylidene-1,5-dihydropyrimido[5,4-b]indol-3-yl)butanamide Traditional Name: N-(2,2-dimethoxyethyl)-4-(4-keto-8-methoxy-2-thioxo-1,5-dihydropyrimid[5,4-b]indol-3-yl)butyramide Formula: C19H24N4O5S MolecularWeight: 420.48266

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H24N4O5S/c1-26-11-6-7-13-12(9-11)16-17(21-13)18(25)23(19(29)22-16)8-4-5-14(24)20-10-15(27-2)28-3/h6-7,9,15,21H,4-5,8,10H2,1-3H3,(H,20,24)(H,22,29)