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

Systemtic Name: 4-(1,2-benzothiazol-3-yl)-N-(4-phenylazanylphenyl)piperazine-1-carbothioamide Openeye Name: N-(4-anilinophenyl)-4-(1,2-benzothiazol-3-yl)piperazine-1-carbothioamide CAS Name: N-(4-anilinophenyl)-4-(1,2-benzothiazol-3-yl)-1-piperazinecarbothioamide IUPAC Name: N-(4-anilinophenyl)-4-(1,2-benzothiazol-3-yl)piperazine-1-carbothioamide Traditional Name: N-(4-anilinophenyl)-4-(1,2-benzothiazol-3-yl)piperazine-1-carbothioamide Formula: C24H23N5S2 MolecularWeight: 445.60292

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NSC3=CC=CC=C32)C(=S)NC4=CC=C(C=C4)NC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=NSC3=CC=CC=C32)C(=S)NC4=CC=C(C=C4)NC5=CC=CC=C5

InChI

InChI=1S/C24H23N5S2/c30-24(26-20-12-10-19(11-13-20)25-18-6-2-1-3-7-18)29-16-14-28(15-17-29)23-21-8-4-5-9-22(21)31-27-23/h1-13,25H,14-17H2,(H,26,30)