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

Systemtic Name: N-(5-methyl-1,3,4-thiadiazol-2-yl)-3-[(2-nitrophenyl)amino]propanamide Openeye Name: N-(5-methyl-1,3,4-thiadiazol-2-yl)-3-(2-nitroanilino)propanamide CAS Name: N-(5-methyl-1,3,4-thiadiazol-2-yl)-3-(2-nitroanilino)propanamide IUPAC Name: N-(5-methyl-1,3,4-thiadiazol-2-yl)-3-(2-nitroanilino)propanamide Traditional Name: N-(5-methyl-1,3,4-thiadiazol-2-yl)-3-(2-nitroanilino)propionamide Formula: C12H13N5O3S MolecularWeight: 307.32832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)NC(=O)CCNC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC1=NN=C(S1)NC(=O)CCNC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C12H13N5O3S/c1-8-15-16-12(21-8)14-11(18)6-7-13-9-4-2-3-5-10(9)17(19)20/h2-5,13H,6-7H2,1H3,(H,14,16,18)