3-(ethylamino)-N-(3-imidazol-1-ylpropyl)-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 3-(ethylamino)-N-(3-imidazol-1-ylpropyl)-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 3-(ethylamino)-N-(3-imidazol-1-ylpropyl)-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 3-(ethylamino)-N-[3-(1-imidazolyl)propyl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 3-(ethylamino)-N-(3-imidazol-1-ylpropyl)-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 3-(ethylamino)-N-(3-imidazol-1-ylpropyl)-5-pyrrolidinosulfonyl-benzamide Formula: C19H27N5O3S MolecularWeight: 405.51438

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=CC(=CC(=C1)C(=O)NCCCN2C=CN=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCNC1=CC(=CC(=C1)C(=O)NCCCN2C=CN=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C19H27N5O3S/c1-2-21-17-12-16(19(25)22-6-5-8-23-11-7-20-15-23)13-18(14-17)28(26,27)24-9-3-4-10-24/h7,11-15,21H,2-6,8-10H2,1H3,(H,22,25)