4-(1,3-benzothiazol-2-ylmethyl)-N-(2-ethylphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylmethyl)-N-(2-ethylphenyl)piperazine-1-carbothioamide Openeye Name: 4-(1,3-benzothiazol-2-ylmethyl)-N-(2-ethylphenyl)piperazine-1-carbothioamide CAS Name: 4-(1,3-benzothiazol-2-ylmethyl)-N-(2-ethylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(1,3-benzothiazol-2-ylmethyl)-N-(2-ethylphenyl)piperazine-1-carbothioamide Traditional Name: 4-(1,3-benzothiazol-2-ylmethyl)-N-(2-ethylphenyl)piperazine-1-carbothioamide Formula: C21H24N4S2 MolecularWeight: 396.57206

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)N2CCN(CC2)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)N2CCN(CC2)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H24N4S2/c1-2-16-7-3-4-8-17(16)23-21(26)25-13-11-24(12-14-25)15-20-22-18-9-5-6-10-19(18)27-20/h3-10H,2,11-15H2,1H3,(H,23,26)