2-[cyclopropyl-[(4-methylphenyl)methyl]amino]-1-(4-methylsulfonylpiperazin-1-yl)ethanone

Systemtic Name: 2-[cyclopropyl-[(4-methylphenyl)methyl]amino]-1-(4-methylsulfonylpiperazin-1-yl)ethanone Openeye Name: 2-[cyclopropyl(p-tolylmethyl)amino]-1-(4-methylsulfonylpiperazin-1-yl)ethanone CAS Name: 2-[cyclopropyl-[(4-methylphenyl)methyl]amino]-1-(4-methylsulfonyl-1-piperazinyl)ethanone IUPAC Name: 2-[cyclopropyl-[(4-methylphenyl)methyl]amino]-1-(4-methylsulfonylpiperazin-1-yl)ethanone Traditional Name: 2-[cyclopropyl-(4-methylbenzyl)amino]-1-(4-mesylpiperazino)ethanone Formula: C18H27N3O3S MolecularWeight: 365.49028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(CC(=O)N2CCN(CC2)S(=O)(=O)C)C3CC3

Isomeric SMILES

CC1=CC=C(C=C1)CN(CC(=O)N2CCN(CC2)S(=O)(=O)C)C3CC3

InChI

InChI=1S/C18H27N3O3S/c1-15-3-5-16(6-4-15)13-20(17-7-8-17)14-18(22)19-9-11-21(12-10-19)25(2,23)24/h3-6,17H,7-14H2,1-2H3