N-[4-(1,3-benzothiazol-2-yl)-2-nitro-phenyl]thiophene-2-carboxamide

Systemtic Name: N-[4-(1,3-benzothiazol-2-yl)-2-nitro-phenyl]thiophene-2-carboxamide Openeye Name: N-[4-(1,3-benzothiazol-2-yl)-2-nitro-phenyl]thiophene-2-carboxamide CAS Name: N-[4-(1,3-benzothiazol-2-yl)-2-nitrophenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-(1,3-benzothiazol-2-yl)-2-nitrophenyl]thiophene-2-carboxamide Traditional Name: N-[4-(1,3-benzothiazol-2-yl)-2-nitro-phenyl]thiophene-2-carboxamide Formula: C18H11N3O3S2 MolecularWeight: 381.42824

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CC(=C(C=C3)NC(=O)C4=CC=CS4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CC(=C(C=C3)NC(=O)C4=CC=CS4)[N+](=O)[O-]

InChI

InChI=1S/C18H11N3O3S2/c22-17(16-6-3-9-25-16)19-12-8-7-11(10-14(12)21(23)24)18-20-13-4-1-2-5-15(13)26-18/h1-10H,(H,19,22)