N-[3-[3-methyl-1-(4-phenylpiperazin-1-yl)cyclohexyl]phenyl]-1,2-benzoxazole-3-carboxamide

Systemtic Name: N-[3-[3-methyl-1-(4-phenylpiperazin-1-yl)cyclohexyl]phenyl]-1,2-benzoxazole-3-carboxamide Openeye Name: N-[3-[3-methyl-1-(4-phenylpiperazin-1-yl)cyclohexyl]phenyl]-1,2-benzoxazole-3-carboxamide CAS Name: N-[3-[3-methyl-1-(4-phenyl-1-piperazinyl)cyclohexyl]phenyl]-1,2-benzoxazole-3-carboxamide IUPAC Name: N-[3-[3-methyl-1-(4-phenylpiperazin-1-yl)cyclohexyl]phenyl]-1,2-benzoxazole-3-carboxamide Traditional Name: N-[3-[3-methyl-1-(4-phenylpiperazino)cyclohexyl]phenyl]indoxazene-3-carboxamide Formula: C31H34N4O2 MolecularWeight: 494.62726

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)(C2=CC(=CC=C2)NC(=O)C3=NOC4=CC=CC=C43)N5CCN(CC5)C6=CC=CC=C6

Isomeric SMILES

CC1CCCC(C1)(C2=CC(=CC=C2)NC(=O)C3=NOC4=CC=CC=C43)N5CCN(CC5)C6=CC=CC=C6

InChI

InChI=1S/C31H34N4O2/c1-23-9-8-16-31(22-23,35-19-17-34(18-20-35)26-12-3-2-4-13-26)24-10-7-11-25(21-24)32-30(36)29-27-14-5-6-15-28(27)37-33-29/h2-7,10-15,21,23H,8-9,16-20,22H2,1H3,(H,32,36)