N-(3-chloranyl-4-methyl-phenyl)-4-(5-methanoylthiophen-2-yl)piperazine-1-carbothioamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-4-(5-methanoylthiophen-2-yl)piperazine-1-carbothioamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-4-(5-formyl-2-thienyl)piperazine-1-carbothioamide CAS Name: N-(3-chloro-4-methylphenyl)-4-(5-formyl-2-thiophenyl)-1-piperazinecarbothioamide IUPAC Name: N-(3-chloro-4-methylphenyl)-4-(5-formylthiophen-2-yl)piperazine-1-carbothioamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-4-(5-formyl-2-thienyl)piperazine-1-carbothioamide Formula: C17H18ClN3OS2 MolecularWeight: 379.92732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18ClN3OS2/c1-12-2-3-13(10-15(12)18)19-17(23)21-8-6-20(7-9-21)16-5-4-14(11-22)24-16/h2-5,10-11H,6-9H2,1H3,(H,19,23)