N-(4-tert-butylphenyl)-4-methanoyl-piperazine-1-carbothioamide

Systemtic Name: N-(4-tert-butylphenyl)-4-methanoyl-piperazine-1-carbothioamide Openeye Name: N-(4-tert-butylphenyl)-4-formyl-piperazine-1-carbothioamide CAS Name: N-(4-tert-butylphenyl)-4-formyl-1-piperazinecarbothioamide IUPAC Name: N-(4-tert-butylphenyl)-4-formylpiperazine-1-carbothioamide Traditional Name: N-(4-tert-butylphenyl)-4-formyl-piperazine-1-carbothioamide Formula: C16H23N3OS MolecularWeight: 305.43832

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N3OS/c1-16(2,3)13-4-6-14(7-5-13)17-15(21)19-10-8-18(12-20)9-11-19/h4-7,12H,8-11H2,1-3H3,(H,17,21)