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

Systemtic Name: N-cycloheptyl-2-(8-methoxy-4-oxidanylidene-2-sulfanylidene-1,5-dihydropyrimido[5,4-b]indol-3-yl)ethanamide Openeye Name: N-cycloheptyl-2-(8-methoxy-4-oxo-2-thioxo-1,5-dihydropyrimido[5,4-b]indol-3-yl)acetamide CAS Name: N-cycloheptyl-2-(8-methoxy-4-oxo-2-sulfanylidene-1,5-dihydropyrimido[5,4-b]indol-3-yl)acetamide IUPAC Name: N-cycloheptyl-2-(8-methoxy-4-oxo-2-sulfanylidene-1,5-dihydropyrimido[5,4-b]indol-3-yl)acetamide Traditional Name: N-cycloheptyl-2-(4-keto-8-methoxy-2-thioxo-1,5-dihydropyrimid[5,4-b]indol-3-yl)acetamide Formula: C20H24N4O3S MolecularWeight: 400.49456

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC3=C2NC(=S)N(C3=O)CC(=O)NC4CCCCCC4

Isomeric SMILES

COC1=CC2=C(C=C1)NC3=C2NC(=S)N(C3=O)CC(=O)NC4CCCCCC4

InChI

InChI=1S/C20H24N4O3S/c1-27-13-8-9-15-14(10-13)17-18(22-15)19(26)24(20(28)23-17)11-16(25)21-12-6-4-2-3-5-7-12/h8-10,12,22H,2-7,11H2,1H3,(H,21,25)(H,23,28)