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

Systemtic Name: N-(2,5-dimethylphenyl)-4-(5-methanoylthiophen-2-yl)piperazine-1-carbothioamide Openeye Name: N-(2,5-dimethylphenyl)-4-(5-formyl-2-thienyl)piperazine-1-carbothioamide CAS Name: N-(2,5-dimethylphenyl)-4-(5-formyl-2-thiophenyl)-1-piperazinecarbothioamide IUPAC Name: N-(2,5-dimethylphenyl)-4-(5-formylthiophen-2-yl)piperazine-1-carbothioamide Traditional Name: N-(2,5-dimethylphenyl)-4-(5-formyl-2-thienyl)piperazine-1-carbothioamide Formula: C18H21N3OS2 MolecularWeight: 359.50884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=S)N2CCN(CC2)C3=CC=C(S3)C=O

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=S)N2CCN(CC2)C3=CC=C(S3)C=O

InChI

InChI=1S/C18H21N3OS2/c1-13-3-4-14(2)16(11-13)19-18(23)21-9-7-20(8-10-21)17-6-5-15(12-22)24-17/h3-6,11-12H,7-10H2,1-2H3,(H,19,23)