N-[2-[(3-chlorophenyl)methyl]pyrazol-3-yl]-4-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[2-[(3-chlorophenyl)methyl]pyrazol-3-yl]-4-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[2-[(3-chlorophenyl)methyl]pyrazol-3-yl]-4-morpholinosulfonyl-benzamide CAS Name: N-[2-[(3-chlorophenyl)methyl]-3-pyrazolyl]-4-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[2-[(3-chlorophenyl)methyl]pyrazol-3-yl]-4-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[2-(3-chlorobenzyl)pyrazol-3-yl]-4-morpholinosulfonyl-benzamide Formula: C21H21ClN4O4S MolecularWeight: 460.93384

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=CC=NN3CC4=CC(=CC=C4)Cl

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=CC=NN3CC4=CC(=CC=C4)Cl

InChI

InChI=1S/C21H21ClN4O4S/c22-18-3-1-2-16(14-18)15-26-20(8-9-23-26)24-21(27)17-4-6-19(7-5-17)31(28,29)25-10-12-30-13-11-25/h1-9,14H,10-13,15H2,(H,24,27)