3-methyl-N-[3-(2-oxidanylideneazepan-1-yl)propyl]-1-phenyl-thieno[2,3-c]pyrazole-5-carboxamide

Systemtic Name: 3-methyl-N-[3-(2-oxidanylideneazepan-1-yl)propyl]-1-phenyl-thieno[2,3-c]pyrazole-5-carboxamide Openeye Name: 3-methyl-N-[3-(2-oxoazepan-1-yl)propyl]-1-phenyl-thieno[2,3-c]pyrazole-5-carboxamide CAS Name: 3-methyl-N-[3-(2-oxo-1-azepanyl)propyl]-1-phenyl-5-thieno[2,3-c]pyrazolecarboxamide IUPAC Name: 3-methyl-N-[3-(2-oxoazepan-1-yl)propyl]-1-phenylthieno[2,3-c]pyrazole-5-carboxamide Traditional Name: N-[3-(2-ketoazepan-1-yl)propyl]-3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carboxamide Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)NCCCN3CCCCCC3=O)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)NCCCN3CCCCCC3=O)C4=CC=CC=C4

InChI

InChI=1S/C22H26N4O2S/c1-16-18-15-19(29-22(18)26(24-16)17-9-4-2-5-10-17)21(28)23-12-8-14-25-13-7-3-6-11-20(25)27/h2,4-5,9-10,15H,3,6-8,11-14H2,1H3,(H,23,28)