N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-[(2-nitrophenyl)amino]propanamide

Systemtic Name: N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-[(2-nitrophenyl)amino]propanamide Openeye Name: N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-3-(2-nitroanilino)propanamide CAS Name: N-[4-(1,3-benzodioxol-5-yl)-2-thiazolyl]-3-(2-nitroanilino)propanamide IUPAC Name: N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-(2-nitroanilino)propanamide Traditional Name: N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-3-(2-nitroanilino)propionamide Formula: C19H16N4O5S MolecularWeight: 412.41914

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=CSC(=N3)NC(=O)CCNC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=CSC(=N3)NC(=O)CCNC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C19H16N4O5S/c24-18(7-8-20-13-3-1-2-4-15(13)23(25)26)22-19-21-14(10-29-19)12-5-6-16-17(9-12)28-11-27-16/h1-6,9-10,20H,7-8,11H2,(H,21,22,24)