4-chloranyl-N-[3-(cyclopropylcarbamoyl)phenyl]-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 4-chloranyl-N-[3-(cyclopropylcarbamoyl)phenyl]-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 4-chloro-N-[3-(cyclopropylcarbamoyl)phenyl]-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 4-chloro-N-[3-[(cyclopropylamino)-oxomethyl]phenyl]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 4-chloro-N-[3-(cyclopropylcarbamoyl)phenyl]-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 4-chloro-N-[3-(cyclopropylcarbamoyl)phenyl]-3-pyrrolidinosulfonyl-benzamide Formula: C21H22ClN3O4S MolecularWeight: 447.93508

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC=CC(=C3)C(=O)NC4CC4)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC=CC(=C3)C(=O)NC4CC4)Cl

InChI

InChI=1S/C21H22ClN3O4S/c22-18-9-6-15(13-19(18)30(28,29)25-10-1-2-11-25)21(27)24-17-5-3-4-14(12-17)20(26)23-16-7-8-16/h3-6,9,12-13,16H,1-2,7-8,10-11H2,(H,23,26)(H,24,27)