4-(2,5-dimethylphenyl)-N-methyl-piperazine-1-carbothioamide

Systemtic Name: 4-(2,5-dimethylphenyl)-N-methyl-piperazine-1-carbothioamide Openeye Name: 4-(2,5-dimethylphenyl)-N-methyl-piperazine-1-carbothioamide CAS Name: 4-(2,5-dimethylphenyl)-N-methyl-1-piperazinecarbothioamide IUPAC Name: 4-(2,5-dimethylphenyl)-N-methylpiperazine-1-carbothioamide Traditional Name: 4-(2,5-dimethylphenyl)-N-methyl-piperazine-1-carbothioamide Formula: C14H21N3S MolecularWeight: 263.40164

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3S/c1-11-4-5-12(2)13(10-11)16-6-8-17(9-7-16)14(18)15-3/h4-5,10H,6-9H2,1-3H3,(H,15,18)