3-(cyclopropylmethylamino)-N-(2-imidazol-1-ylethyl)-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 3-(cyclopropylmethylamino)-N-(2-imidazol-1-ylethyl)-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 3-(cyclopropylmethylamino)-N-(2-imidazol-1-ylethyl)-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 3-(cyclopropylmethylamino)-N-[2-(1-imidazolyl)ethyl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 3-(cyclopropylmethylamino)-N-(2-imidazol-1-ylethyl)-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 3-(cyclopropylmethylamino)-N-(2-imidazol-1-ylethyl)-5-pyrrolidinosulfonyl-benzamide Formula: C20H27N5O3S MolecularWeight: 417.52508

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=CC(=C2)NCC3CC3)C(=O)NCCN4C=CN=C4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=CC(=C2)NCC3CC3)C(=O)NCCN4C=CN=C4

InChI

InChI=1S/C20H27N5O3S/c26-20(22-6-10-24-9-5-21-15-24)17-11-18(23-14-16-3-4-16)13-19(12-17)29(27,28)25-7-1-2-8-25/h5,9,11-13,15-16,23H,1-4,6-8,10,14H2,(H,22,26)