N-[(6-nitro-1,3-benzothiazol-2-yl)carbamothioyl]-2,2-diphenyl-ethanamide

Systemtic Name: N-[(6-nitro-1,3-benzothiazol-2-yl)carbamothioyl]-2,2-diphenyl-ethanamide Openeye Name: N-[(6-nitro-1,3-benzothiazol-2-yl)carbamothioyl]-2,2-diphenyl-acetamide CAS Name: N-[[(6-nitro-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-2,2-diphenylacetamide IUPAC Name: N-[(6-nitro-1,3-benzothiazol-2-yl)carbamothioyl]-2,2-diphenylacetamide Traditional Name: N-[(6-nitro-1,3-benzothiazol-2-yl)thiocarbamoyl]-2,2-diphenyl-acetamide Formula: C22H16N4O3S2 MolecularWeight: 448.51744

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)NC(=S)NC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)NC(=S)NC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H16N4O3S2/c27-20(19(14-7-3-1-4-8-14)15-9-5-2-6-10-15)24-21(30)25-22-23-17-12-11-16(26(28)29)13-18(17)31-22/h1-13,19H,(H2,23,24,25,27,30)