2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: 2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Openeye Name: 2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide CAS Name: 2-[(6-methyl-1H-benzimidazol-2-yl)thio]-N-[4-(1-pyrrolidinylsulfonyl)phenyl]propanamide IUPAC Name: 2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Traditional Name: 2-[(6-methyl-1H-benzimidazol-2-yl)thio]-N-(4-pyrrolidinosulfonylphenyl)propionamide Formula: C21H24N4O3S2 MolecularWeight: 444.57026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)SC(C)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)SC(C)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C21H24N4O3S2/c1-14-5-10-18-19(13-14)24-21(23-18)29-15(2)20(26)22-16-6-8-17(9-7-16)30(27,28)25-11-3-4-12-25/h5-10,13,15H,3-4,11-12H2,1-2H3,(H,22,26)(H,23,24)