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

Systemtic Name: 3-[(4-nitrophenyl)sulfonylamino]-N-(5-pentan-2-yl-1,3,4-thiadiazol-2-yl)propanamide Openeye Name: N-[5-(1-methylbutyl)-1,3,4-thiadiazol-2-yl]-3-[(4-nitrophenyl)sulfonylamino]propanamide CAS Name: 3-[(4-nitrophenyl)sulfonylamino]-N-(5-pentan-2-yl-1,3,4-thiadiazol-2-yl)propanamide IUPAC Name: 3-[(4-nitrophenyl)sulfonylamino]-N-(5-pentan-2-yl-1,3,4-thiadiazol-2-yl)propanamide Traditional Name: N-[5-(1-methylbutyl)-1,3,4-thiadiazol-2-yl]-3-(nosylamino)propionamide Formula: C16H21N5O5S2 MolecularWeight: 427.49844

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C1=NN=C(S1)NC(=O)CCNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCC(C)C1=NN=C(S1)NC(=O)CCNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H21N5O5S2/c1-3-4-11(2)15-19-20-16(27-15)18-14(22)9-10-17-28(25,26)13-7-5-12(6-8-13)21(23)24/h5-8,11,17H,3-4,9-10H2,1-2H3,(H,18,20,22)