1-(2-methylphenyl)-3-[1-(4-methylpiperazin-1-yl)-1-phenyl-propan-2-yl]thiourea

Systemtic Name: 1-(2-methylphenyl)-3-[1-(4-methylpiperazin-1-yl)-1-phenyl-propan-2-yl]thiourea Openeye Name: 1-[1-methyl-2-(4-methylpiperazin-1-yl)-2-phenyl-ethyl]-3-(o-tolyl)thiourea CAS Name: 1-(2-methylphenyl)-3-[1-(4-methyl-1-piperazinyl)-1-phenylpropan-2-yl]thiourea IUPAC Name: 1-(2-methylphenyl)-3-[1-(4-methylpiperazin-1-yl)-1-phenylpropan-2-yl]thiourea Traditional Name: 1-[1-methyl-2-(4-methylpiperazino)-2-phenyl-ethyl]-3-(o-tolyl)thiourea Formula: C22H30N4S MolecularWeight: 382.5654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)NC(C)C(C2=CC=CC=C2)N3CCN(CC3)C

Isomeric SMILES

CC1=CC=CC=C1NC(=S)NC(C)C(C2=CC=CC=C2)N3CCN(CC3)C

InChI

InChI=1S/C22H30N4S/c1-17-9-7-8-12-20(17)24-22(27)23-18(2)21(19-10-5-4-6-11-19)26-15-13-25(3)14-16-26/h4-12,18,21H,13-16H2,1-3H3,(H2,23,24,27)