N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]-1-phenyl-5,6,7,8-tetrahydro-4H-cyclohepta[c]pyrazole-3-carboxamide

Systemtic Name: N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]-1-phenyl-5,6,7,8-tetrahydro-4H-cyclohepta[c]pyrazole-3-carboxamide Openeye Name: N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]-1-phenyl-5,6,7,8-tetrahydro-4H-cyclohepta[c]pyrazole-3-carboxamide CAS Name: N-[2-methyl-4-(4-methyl-1-piperazinyl)phenyl]-1-phenyl-5,6,7,8-tetrahydro-4H-cyclohepta[c]pyrazole-3-carboxamide IUPAC Name: N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]-1-phenyl-5,6,7,8-tetrahydro-4H-cyclohepta[c]pyrazole-3-carboxamide Traditional Name: N-[2-methyl-4-(4-methylpiperazino)phenyl]-1-phenyl-5,6,7,8-tetrahydro-4H-cyclohepta[c]pyrazole-3-carboxamide Formula: C27H33N5O MolecularWeight: 443.58382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CCN(CC2)C)NC(=O)C3=NN(C4=C3CCCCC4)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C=CC(=C1)N2CCN(CC2)C)NC(=O)C3=NN(C4=C3CCCCC4)C5=CC=CC=C5

InChI

InChI=1S/C27H33N5O/c1-20-19-22(31-17-15-30(2)16-18-31)13-14-24(20)28-27(33)26-23-11-7-4-8-12-25(23)32(29-26)21-9-5-3-6-10-21/h3,5-6,9-10,13-14,19H,4,7-8,11-12,15-18H2,1-2H3,(H,28,33)