1-methyl-3-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]thiourea

Systemtic Name: 1-methyl-3-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]thiourea Openeye Name: 1-methyl-3-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]thiourea CAS Name: 1-methyl-3-[4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]thiourea IUPAC Name: 1-methyl-3-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]thiourea Traditional Name: 1-methyl-3-[4-(4-methylpiperazino)sulfonylphenyl]thiourea Formula: C13H20N4O2S2 MolecularWeight: 328.4535

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C

Isomeric SMILES

CNC(=S)NC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C

InChI

InChI=1S/C13H20N4O2S2/c1-14-13(20)15-11-3-5-12(6-4-11)21(18,19)17-9-7-16(2)8-10-17/h3-6H,7-10H2,1-2H3,(H2,14,15,20)