N-[2-[4-(5-tert-butyl-2-methyl-pyrazol-3-yl)carbonylpiperazin-1-yl]-5-(1,4-diazepan-1-ylcarbonyl)phenyl]benzamide

Systemtic Name: N-[2-[4-(5-tert-butyl-2-methyl-pyrazol-3-yl)carbonylpiperazin-1-yl]-5-(1,4-diazepan-1-ylcarbonyl)phenyl]benzamide Openeye Name: N-[2-[4-(5-tert-butyl-2-methyl-pyrazole-3-carbonyl)piperazin-1-yl]-5-(1,4-diazepane-1-carbonyl)phenyl]benzamide CAS Name: N-[2-[4-[(5-tert-butyl-2-methyl-3-pyrazolyl)-oxomethyl]-1-piperazinyl]-5-[1,4-diazepan-1-yl(oxo)methyl]phenyl]benzamide IUPAC Name: N-[2-[4-(5-tert-butyl-2-methylpyrazole-3-carbonyl)piperazin-1-yl]-5-(1,4-diazepane-1-carbonyl)phenyl]benzamide Traditional Name: N-[2-[4-(5-tert-butyl-2-methyl-pyrazole-3-carbonyl)piperazino]-5-(1,4-diazepane-1-carbonyl)phenyl]benzamide Formula: C32H41N7O3 MolecularWeight: 571.71304

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)N4CCCNCC4)NC(=O)C5=CC=CC=C5)C

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)N4CCCNCC4)NC(=O)C5=CC=CC=C5)C

InChI

InChI=1S/C32H41N7O3/c1-32(2,3)28-22-27(36(4)35-28)31(42)39-19-17-37(18-20-39)26-12-11-24(30(41)38-15-8-13-33-14-16-38)21-25(26)34-29(40)23-9-6-5-7-10-23/h5-7,9-12,21-22,33H,8,13-20H2,1-4H3,(H,34,40)