[1-[[4-cyano-1-(4-methylpiperazin-1-yl)carbonyl-piperidin-4-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl] N-(phenylmethyl)carbamate

Systemtic Name: [1-[[4-cyano-1-(4-methylpiperazin-1-yl)carbonyl-piperidin-4-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl] N-(phenylmethyl)carbamate Openeye Name: [1-[[4-cyano-1-(4-methylpiperazine-1-carbonyl)-4-piperidyl]carbamoyl]-3-methyl-butyl] N-benzylcarbamate CAS Name: N-(phenylmethyl)carbamic acid [1-[[4-cyano-1-[(4-methyl-1-piperazinyl)-oxomethyl]-4-piperidinyl]amino]-4-methyl-1-oxopentan-2-yl] ester IUPAC Name: [1-[[4-cyano-1-(4-methylpiperazine-1-carbonyl)piperidin-4-yl]amino]-4-methyl-1-oxopentan-2-yl] N-benzylcarbamate Traditional Name: N-benzylcarbamic acid [1-[[4-cyano-1-(4-methylpiperazine-1-carbonyl)-4-piperidyl]carbamoyl]-3-methyl-butyl] ester Formula: C26H38N6O4 MolecularWeight: 498.61772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1(CCN(CC1)C(=O)N2CCN(CC2)C)C#N)OC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC(C)CC(C(=O)NC1(CCN(CC1)C(=O)N2CCN(CC2)C)C#N)OC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C26H38N6O4/c1-20(2)17-22(36-24(34)28-18-21-7-5-4-6-8-21)23(33)29-26(19-27)9-11-31(12-10-26)25(35)32-15-13-30(3)14-16-32/h4-8,20,22H,9-18H2,1-3H3,(H,28,34)(H,29,33)