4-chloranyl-N-[(4-imidazol-1-ylphenyl)methyl]-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 4-chloranyl-N-[(4-imidazol-1-ylphenyl)methyl]-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 4-chloro-N-[(4-imidazol-1-ylphenyl)methyl]-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 4-chloro-N-[[4-(1-imidazolyl)phenyl]methyl]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 4-chloro-N-[(4-imidazol-1-ylphenyl)methyl]-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 4-chloro-N-(4-imidazol-1-ylbenzyl)-3-pyrrolidinosulfonyl-benzamide Formula: C21H21ClN4O3S MolecularWeight: 444.93444

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCC3=CC=C(C=C3)N4C=CN=C4)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCC3=CC=C(C=C3)N4C=CN=C4)Cl

InChI

InChI=1S/C21H21ClN4O3S/c22-19-8-5-17(13-20(19)30(28,29)26-10-1-2-11-26)21(27)24-14-16-3-6-18(7-4-16)25-12-9-23-15-25/h3-9,12-13,15H,1-2,10-11,14H2,(H,24,27)