3-(3-methyl-2-oxidanylidene-benzimidazol-1-yl)-N-[(5-piperidin-1-ylsulfonylthiophen-2-yl)methyl]propanamide

Systemtic Name: 3-(3-methyl-2-oxidanylidene-benzimidazol-1-yl)-N-[(5-piperidin-1-ylsulfonylthiophen-2-yl)methyl]propanamide Openeye Name: 3-(3-methyl-2-oxo-benzimidazol-1-yl)-N-[[5-(1-piperidylsulfonyl)-2-thienyl]methyl]propanamide CAS Name: 3-(3-methyl-2-oxo-1-benzimidazolyl)-N-[[5-(1-piperidinylsulfonyl)-2-thiophenyl]methyl]propanamide IUPAC Name: 3-(3-methyl-2-oxobenzimidazol-1-yl)-N-[(5-piperidin-1-ylsulfonylthiophen-2-yl)methyl]propanamide Traditional Name: 3-(2-keto-3-methyl-benzimidazol-1-yl)-N-[(5-piperidinosulfonyl-2-thienyl)methyl]propionamide Formula: C21H26N4O4S2 MolecularWeight: 462.58554

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N(C1=O)CCC(=O)NCC3=CC=C(S3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CN1C2=CC=CC=C2N(C1=O)CCC(=O)NCC3=CC=C(S3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C21H26N4O4S2/c1-23-17-7-3-4-8-18(17)25(21(23)27)14-11-19(26)22-15-16-9-10-20(30-16)31(28,29)24-12-5-2-6-13-24/h3-4,7-10H,2,5-6,11-15H2,1H3,(H,22,26)