N-[(5-chloranyl-6-methyl-1,3-benzothiazol-2-yl)carbamothioyl]-4-phenyl-benzamide

Systemtic Name: N-[(5-chloranyl-6-methyl-1,3-benzothiazol-2-yl)carbamothioyl]-4-phenyl-benzamide Openeye Name: N-[(5-chloro-6-methyl-1,3-benzothiazol-2-yl)carbamothioyl]-4-phenyl-benzamide CAS Name: N-[[(5-chloro-6-methyl-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-4-phenylbenzamide IUPAC Name: N-[(5-chloro-6-methyl-1,3-benzothiazol-2-yl)carbamothioyl]-4-phenylbenzamide Traditional Name: N-[(5-chloro-6-methyl-1,3-benzothiazol-2-yl)thiocarbamoyl]-4-phenyl-benzamide Formula: C22H16ClN3OS2 MolecularWeight: 437.96494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1Cl)N=C(S2)NC(=S)NC(=O)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1Cl)N=C(S2)NC(=S)NC(=O)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H16ClN3OS2/c1-13-11-19-18(12-17(13)23)24-22(29-19)26-21(28)25-20(27)16-9-7-15(8-10-16)14-5-3-2-4-6-14/h2-12H,1H3,(H2,24,25,26,27,28)