4-(1,2-benzothiazol-3-yl)-N-(4-ethoxyphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-(1,2-benzothiazol-3-yl)-N-(4-ethoxyphenyl)piperazine-1-carbothioamide Openeye Name: 4-(1,2-benzothiazol-3-yl)-N-(4-ethoxyphenyl)piperazine-1-carbothioamide CAS Name: 4-(1,2-benzothiazol-3-yl)-N-(4-ethoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(1,2-benzothiazol-3-yl)-N-(4-ethoxyphenyl)piperazine-1-carbothioamide Traditional Name: 4-(1,2-benzothiazol-3-yl)-N-p-phenetyl-piperazine-1-carbothioamide Formula: C20H22N4OS2 MolecularWeight: 398.54488

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)N2CCN(CC2)C3=NSC4=CC=CC=C43

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)N2CCN(CC2)C3=NSC4=CC=CC=C43

InChI

InChI=1S/C20H22N4OS2/c1-2-25-16-9-7-15(8-10-16)21-20(26)24-13-11-23(12-14-24)19-17-5-3-4-6-18(17)27-22-19/h3-10H,2,11-14H2,1H3,(H,21,26)