N-[4-(azepan-1-ylsulfonyl)phenyl]-3-phenyl-1H-pyrazole-5-carboxamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-phenyl-1H-pyrazole-5-carboxamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-phenyl-1H-pyrazole-5-carboxamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-3-phenyl-1H-pyrazole-5-carboxamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-phenyl-1H-pyrazole-5-carboxamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-phenyl-1H-pyrazole-5-carboxamide Formula: C22H24N4O3S MolecularWeight: 424.51596

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=NN3)C4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=NN3)C4=CC=CC=C4

InChI

InChI=1S/C22H24N4O3S/c27-22(21-16-20(24-25-21)17-8-4-3-5-9-17)23-18-10-12-19(13-11-18)30(28,29)26-14-6-1-2-7-15-26/h3-5,8-13,16H,1-2,6-7,14-15H2,(H,23,27)(H,24,25)