5-chloranyl-N-(6-oxidanylidene-2-sulfanylidene-1,3-diazinan-1-yl)-1H-indole-2-carboxamide

Systemtic Name: 5-chloranyl-N-(6-oxidanylidene-2-sulfanylidene-1,3-diazinan-1-yl)-1H-indole-2-carboxamide Openeye Name: 5-chloro-N-(6-oxo-2-thioxo-hexahydropyrimidin-1-yl)-1H-indole-2-carboxamide CAS Name: 5-chloro-N-(6-oxo-2-sulfanylidene-1,3-diazinan-1-yl)-1H-indole-2-carboxamide IUPAC Name: 5-chloro-N-(6-oxo-2-sulfanylidene-1,3-diazinan-1-yl)-1H-indole-2-carboxamide Traditional Name: 5-chloro-N-(6-keto-2-thioxo-hexahydropyrimidin-1-yl)-1H-indole-2-carboxamide Formula: C13H11ClN4O2S MolecularWeight: 322.77004

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=S)N(C1=O)NC(=O)C2=CC3=C(N2)C=CC(=C3)Cl

Isomeric SMILES

C1CNC(=S)N(C1=O)NC(=O)C2=CC3=C(N2)C=CC(=C3)Cl

InChI

InChI=1S/C13H11ClN4O2S/c14-8-1-2-9-7(5-8)6-10(16-9)12(20)17-18-11(19)3-4-15-13(18)21/h1-2,5-6,16H,3-4H2,(H,15,21)(H,17,20)