2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]-N-phenyl-N-propan-2-yl-ethanamide

Systemtic Name: 2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]-N-phenyl-N-propan-2-yl-ethanamide Openeye Name: N-isopropyl-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]-N-phenyl-acetamide CAS Name: 2-[(6-nitro-1,3-benzothiazol-2-yl)thio]-N-phenyl-N-propan-2-ylacetamide IUPAC Name: 2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]-N-phenyl-N-propan-2-ylacetamide Traditional Name: N-isopropyl-2-[(6-nitro-1,3-benzothiazol-2-yl)thio]-N-phenyl-acetamide Formula: C18H17N3O3S2 MolecularWeight: 387.47588

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=CC=CC=C1)C(=O)CSC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)N(C1=CC=CC=C1)C(=O)CSC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O3S2/c1-12(2)20(13-6-4-3-5-7-13)17(22)11-25-18-19-15-9-8-14(21(23)24)10-16(15)26-18/h3-10,12H,11H2,1-2H3