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

Systemtic Name: 3-(4-butylphenyl)-1-methyl-1-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]thiourea Openeye Name: 3-(4-butylphenyl)-1-methyl-1-[2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]thiourea CAS Name: 3-(4-butylphenyl)-1-methyl-1-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]thiourea IUPAC Name: 3-(4-butylphenyl)-1-methyl-1-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]thiourea Traditional Name: 3-(4-butylphenyl)-1-[2-keto-2-(4-methylpiperazino)ethyl]-1-methyl-thiourea Formula: C19H30N4OS MolecularWeight: 362.5327

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)N(C)CC(=O)N2CCN(CC2)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)N(C)CC(=O)N2CCN(CC2)C

InChI

InChI=1S/C19H30N4OS/c1-4-5-6-16-7-9-17(10-8-16)20-19(25)22(3)15-18(24)23-13-11-21(2)12-14-23/h7-10H,4-6,11-15H2,1-3H3,(H,20,25)