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

Systemtic Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2,2-diphenyl-ethanamide Openeye Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2,2-diphenyl-acetamide CAS Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2,2-diphenylacetamide IUPAC Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2,2-diphenylacetamide Traditional Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2,2-diphenyl-acetamide Formula: C21H15N3O3S MolecularWeight: 389.4271

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C21H15N3O3S/c25-20(19(14-7-3-1-4-8-14)15-9-5-2-6-10-15)23-21-22-17-12-11-16(24(26)27)13-18(17)28-21/h1-13,19H,(H,22,23,25)