N-(1,3-benzothiazol-2-ylmethyl)-3-[(2-nitrophenyl)amino]propanamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-3-[(2-nitrophenyl)amino]propanamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-3-(2-nitroanilino)propanamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-3-(2-nitroanilino)propanamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-3-(2-nitroanilino)propanamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-3-(2-nitroanilino)propionamide Formula: C17H16N4O3S MolecularWeight: 356.39894

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CNC(=O)CCNC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CNC(=O)CCNC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C17H16N4O3S/c22-16(9-10-18-12-5-1-3-7-14(12)21(23)24)19-11-17-20-13-6-2-4-8-15(13)25-17/h1-8,18H,9-11H2,(H,19,22)