(phenylmethyl) N-[(2S,3S)-3-methyl-1-[(4-methylpiperazin-1-yl)amino]-1-oxidanylidene-pentan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S,3S)-3-methyl-1-[(4-methylpiperazin-1-yl)amino]-1-oxidanylidene-pentan-2-yl]carbamate Openeye Name: benzyl N-[(1S,2S)-2-methyl-1-[(4-methylpiperazin-1-yl)carbamoyl]butyl]carbamate CAS Name: N-[(2S,3S)-3-methyl-1-[(4-methyl-1-piperazinyl)amino]-1-oxopentan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S,3S)-3-methyl-1-[(4-methylpiperazin-1-yl)amino]-1-oxopentan-2-yl]carbamate Traditional Name: N-[(1S,2S)-2-methyl-1-[(4-methylpiperazino)carbamoyl]butyl]carbamic acid benzyl ester Formula: C19H30N4O3 MolecularWeight: 362.4665

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NN1CCN(CC1)C)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)NN1CCN(CC1)C)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C19H30N4O3/c1-4-15(2)17(18(24)21-23-12-10-22(3)11-13-23)20-19(25)26-14-16-8-6-5-7-9-16/h5-9,15,17H,4,10-14H2,1-3H3,(H,20,25)(H,21,24)/t15-,17-/m0/s1