2,4-bis(chloranyl)-N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2,4-bis(chloranyl)-N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2,4-dichloro-N-[1-(o-tolylmethyl)pyrazol-4-yl]-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2,4-dichloro-N-[1-[(2-methylphenyl)methyl]-4-pyrazolyl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2,4-dichloro-N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2,4-dichloro-N-[1-(2-methylbenzyl)pyrazol-4-yl]-5-pyrrolidinosulfonyl-benzamide Formula: C22H22Cl2N4O3S MolecularWeight: 493.40608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=C(C=N2)NC(=O)C3=CC(=C(C=C3Cl)Cl)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=CC=CC=C1CN2C=C(C=N2)NC(=O)C3=CC(=C(C=C3Cl)Cl)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C22H22Cl2N4O3S/c1-15-6-2-3-7-16(15)13-27-14-17(12-25-27)26-22(29)18-10-21(20(24)11-19(18)23)32(30,31)28-8-4-5-9-28/h2-3,6-7,10-12,14H,4-5,8-9,13H2,1H3,(H,26,29)