N-(2-imidazol-1-ylethyl)-3-[[(E)-2-methylbut-2-enyl]amino]-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(2-imidazol-1-ylethyl)-3-[[(E)-2-methylbut-2-enyl]amino]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(2-imidazol-1-ylethyl)-3-[[(E)-2-methylbut-2-enyl]amino]-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[2-(1-imidazolyl)ethyl]-3-[[(E)-2-methylbut-2-enyl]amino]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(2-imidazol-1-ylethyl)-3-[[(E)-2-methylbut-2-enyl]amino]-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(2-imidazol-1-ylethyl)-3-[[(E)-2-methylbut-2-enyl]amino]-5-pyrrolidinosulfonyl-benzamide Formula: C21H29N5O3S MolecularWeight: 431.55166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=C(C)CNC1=CC(=CC(=C1)C(=O)NCCN2C=CN=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

C/C=C(\C)/CNC1=CC(=CC(=C1)C(=O)NCCN2C=CN=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C21H29N5O3S/c1-3-17(2)15-24-19-12-18(21(27)23-7-11-25-10-6-22-16-25)13-20(14-19)30(28,29)26-8-4-5-9-26/h3,6,10,12-14,16,24H,4-5,7-9,11,15H2,1-2H3,(H,23,27)/b17-3+