N-(3-imidazol-1-ylpropyl)-3-[(5-methylthiophen-2-yl)methylamino]-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(3-imidazol-1-ylpropyl)-3-[(5-methylthiophen-2-yl)methylamino]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(3-imidazol-1-ylpropyl)-3-[(5-methyl-2-thienyl)methylamino]-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[3-(1-imidazolyl)propyl]-3-[(5-methyl-2-thiophenyl)methylamino]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(3-imidazol-1-ylpropyl)-3-[(5-methylthiophen-2-yl)methylamino]-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(3-imidazol-1-ylpropyl)-3-[(5-methyl-2-thienyl)methylamino]-5-pyrrolidinosulfonyl-benzamide Formula: C23H29N5O3S2 MolecularWeight: 487.63806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)CNC2=CC(=CC(=C2)C(=O)NCCCN3C=CN=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=CC=C(S1)CNC2=CC(=CC(=C2)C(=O)NCCCN3C=CN=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C23H29N5O3S2/c1-18-5-6-21(32-18)16-26-20-13-19(23(29)25-7-4-9-27-12-8-24-17-27)14-22(15-20)33(30,31)28-10-2-3-11-28/h5-6,8,12-15,17,26H,2-4,7,9-11,16H2,1H3,(H,25,29)