3-[(4-nitrophenyl)methylidene]-2-oxidanylidene-4-sulfanylidene-6,7,8,9-tetrahydro-1H-pyrimido[1,2-a]indole-10-carboxamide

Systemtic Name: 3-[(4-nitrophenyl)methylidene]-2-oxidanylidene-4-sulfanylidene-6,7,8,9-tetrahydro-1H-pyrimido[1,2-a]indole-10-carboxamide Openeye Name: 3-[(4-nitrophenyl)methylene]-2-oxo-4-thioxo-6,7,8,9-tetrahydro-1H-pyrimido[1,2-a]indole-10-carboxamide CAS Name: 3-[(4-nitrophenyl)methylidene]-2-oxo-4-sulfanylidene-6,7,8,9-tetrahydro-1H-pyrimido[1,2-a]indole-10-carboxamide IUPAC Name: 3-[(4-nitrophenyl)methylidene]-2-oxo-4-sulfanylidene-6,7,8,9-tetrahydro-1H-pyrimido[1,2-a]indole-10-carboxamide Traditional Name: 2-keto-3-(4-nitrobenzylidene)-4-thioxo-6,7,8,9-tetrahydro-1H-pyrimid[1,2-a]indole-10-carboxamide Formula: C19H16N4O4S MolecularWeight: 396.41974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C3N2C(=S)C(=CC4=CC=C(C=C4)[N+](=O)[O-])C(=O)N3)C(=O)N

Isomeric SMILES

C1CCC2=C(C1)C(=C3N2C(=S)C(=CC4=CC=C(C=C4)[N+](=O)[O-])C(=O)N3)C(=O)N

InChI

InChI=1S/C19H16N4O4S/c20-16(24)15-12-3-1-2-4-14(12)22-17(15)21-18(25)13(19(22)28)9-10-5-7-11(8-6-10)23(26)27/h5-9H,1-4H2,(H2,20,24)(H,21,25)