N-(3,5-dimethylphenyl)-4-methanoyl-piperazine-1-carbothioamide

Systemtic Name: N-(3,5-dimethylphenyl)-4-methanoyl-piperazine-1-carbothioamide Openeye Name: N-(3,5-dimethylphenyl)-4-formyl-piperazine-1-carbothioamide CAS Name: N-(3,5-dimethylphenyl)-4-formyl-1-piperazinecarbothioamide IUPAC Name: N-(3,5-dimethylphenyl)-4-formylpiperazine-1-carbothioamide Traditional Name: N-(3,5-dimethylphenyl)-4-formyl-piperazine-1-carbothioamide Formula: C14H19N3OS MolecularWeight: 277.38516

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19N3OS/c1-11-7-12(2)9-13(8-11)15-14(19)17-5-3-16(10-18)4-6-17/h7-10H,3-6H2,1-2H3,(H,15,19)