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

Systemtic Name: 3-[(2-nitrophenyl)amino]-N-(5-pentyl-1,3,4-thiadiazol-2-yl)propanamide Openeye Name: 3-(2-nitroanilino)-N-(5-pentyl-1,3,4-thiadiazol-2-yl)propanamide CAS Name: 3-(2-nitroanilino)-N-(5-pentyl-1,3,4-thiadiazol-2-yl)propanamide IUPAC Name: 3-(2-nitroanilino)-N-(5-pentyl-1,3,4-thiadiazol-2-yl)propanamide Traditional Name: N-(5-amyl-1,3,4-thiadiazol-2-yl)-3-(2-nitroanilino)propionamide Formula: C16H21N5O3S MolecularWeight: 363.43464

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NN=C(S1)NC(=O)CCNC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCCCCC1=NN=C(S1)NC(=O)CCNC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C16H21N5O3S/c1-2-3-4-9-15-19-20-16(25-15)18-14(22)10-11-17-12-7-5-6-8-13(12)21(23)24/h5-8,17H,2-4,9-11H2,1H3,(H,18,20,22)