N-(4-methoxy-1,3-benzothiazol-2-yl)-3-[(2-nitrophenyl)amino]propanamide

Systemtic Name: N-(4-methoxy-1,3-benzothiazol-2-yl)-3-[(2-nitrophenyl)amino]propanamide Openeye Name: N-(4-methoxy-1,3-benzothiazol-2-yl)-3-(2-nitroanilino)propanamide CAS Name: N-(4-methoxy-1,3-benzothiazol-2-yl)-3-(2-nitroanilino)propanamide IUPAC Name: N-(4-methoxy-1,3-benzothiazol-2-yl)-3-(2-nitroanilino)propanamide Traditional Name: N-(4-methoxy-1,3-benzothiazol-2-yl)-3-(2-nitroanilino)propionamide Formula: C17H16N4O4S MolecularWeight: 372.39834

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC=C1)SC(=N2)NC(=O)CCNC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

COC1=C2C(=CC=C1)SC(=N2)NC(=O)CCNC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C17H16N4O4S/c1-25-13-7-4-8-14-16(13)20-17(26-14)19-15(22)9-10-18-11-5-2-3-6-12(11)21(23)24/h2-8,18H,9-10H2,1H3,(H,19,20,22)