3-(2,5-dimethylphenyl)-1-methyl-1-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]thiourea

Systemtic Name: 3-(2,5-dimethylphenyl)-1-methyl-1-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]thiourea Openeye Name: 3-(2,5-dimethylphenyl)-1-methyl-1-[2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]thiourea CAS Name: 3-(2,5-dimethylphenyl)-1-methyl-1-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]thiourea IUPAC Name: 3-(2,5-dimethylphenyl)-1-methyl-1-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]thiourea Traditional Name: 3-(2,5-dimethylphenyl)-1-[2-keto-2-(4-methylpiperazino)ethyl]-1-methyl-thiourea Formula: C17H26N4OS MolecularWeight: 334.47954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=S)N(C)CC(=O)N2CCN(CC2)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=S)N(C)CC(=O)N2CCN(CC2)C

InChI

InChI=1S/C17H26N4OS/c1-13-5-6-14(2)15(11-13)18-17(23)20(4)12-16(22)21-9-7-19(3)8-10-21/h5-6,11H,7-10,12H2,1-4H3,(H,18,23)