2-[2-(4-cyano-3-methyl-pyrido[1,2-a]benzimidazol-1-yl)sulfanylethanoylamino]thiophene-3-carboxamide

Systemtic Name: 2-[2-(4-cyano-3-methyl-pyrido[1,2-a]benzimidazol-1-yl)sulfanylethanoylamino]thiophene-3-carboxamide Openeye Name: 2-[[2-(4-cyano-3-methyl-pyrido[1,2-a]benzimidazol-1-yl)sulfanylacetyl]amino]thiophene-3-carboxamide CAS Name: 2-[[2-[(4-cyano-3-methyl-1-pyrido[1,2-a]benzimidazolyl)thio]-1-oxoethyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[[2-(4-cyano-3-methylpyrido[1,2-a]benzimidazol-1-yl)sulfanylacetyl]amino]thiophene-3-carboxamide Traditional Name: 2-[[2-[(4-cyano-3-methyl-pyrido[1,2-a]benzimidazol-1-yl)thio]acetyl]amino]thiophene-3-carboxamide Formula: C20H15N5O2S2 MolecularWeight: 421.4954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC(=O)NC4=C(C=CS4)C(=O)N)C#N

Isomeric SMILES

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC(=O)NC4=C(C=CS4)C(=O)N)C#N

InChI

InChI=1S/C20H15N5O2S2/c1-11-8-17(29-10-16(26)24-20-12(18(22)27)6-7-28-20)25-15-5-3-2-4-14(15)23-19(25)13(11)9-21/h2-8H,10H2,1H3,(H2,22,27)(H,24,26)