3-(3-chloranyl-4-methyl-phenyl)-1-methyl-1-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]thiourea

Systemtic Name: 3-(3-chloranyl-4-methyl-phenyl)-1-methyl-1-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]thiourea Openeye Name: 3-(3-chloro-4-methyl-phenyl)-1-methyl-1-[2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]thiourea CAS Name: 3-(3-chloro-4-methylphenyl)-1-methyl-1-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]thiourea IUPAC Name: 3-(3-chloro-4-methylphenyl)-1-methyl-1-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]thiourea Traditional Name: 3-(3-chloro-4-methyl-phenyl)-1-[2-keto-2-(4-methylpiperazino)ethyl]-1-methyl-thiourea Formula: C16H23ClN4OS MolecularWeight: 354.89802

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23ClN4OS/c1-12-4-5-13(10-14(12)17)18-16(23)20(3)11-15(22)21-8-6-19(2)7-9-21/h4-5,10H,6-9,11H2,1-3H3,(H,18,23)