4-chloranyl-N-[1-(4-ethylphenyl)-2-methyl-propyl]-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 4-chloranyl-N-[1-(4-ethylphenyl)-2-methyl-propyl]-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 4-chloro-N-[1-(4-ethylphenyl)-2-methyl-propyl]-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 4-chloro-N-[1-(4-ethylphenyl)-2-methylpropyl]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 4-chloro-N-[1-(4-ethylphenyl)-2-methylpropyl]-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 4-chloro-N-[1-(4-ethylphenyl)-2-methyl-propyl]-3-pyrrolidinosulfonyl-benzamide Formula: C23H29ClN2O3S MolecularWeight: 449.00596

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C(C)C)NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCC1=CC=C(C=C1)C(C(C)C)NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C23H29ClN2O3S/c1-4-17-7-9-18(10-8-17)22(16(2)3)25-23(27)19-11-12-20(24)21(15-19)30(28,29)26-13-5-6-14-26/h7-12,15-16,22H,4-6,13-14H2,1-3H3,(H,25,27)