3-methoxy-N-[2-[5-[(4-nitrophenyl)carbonylamino]-1,3,4-thiadiazol-2-yl]ethyl]benzamide

Systemtic Name: 3-methoxy-N-[2-[5-[(4-nitrophenyl)carbonylamino]-1,3,4-thiadiazol-2-yl]ethyl]benzamide Openeye Name: 3-methoxy-N-[2-[5-[(4-nitrobenzoyl)amino]-1,3,4-thiadiazol-2-yl]ethyl]benzamide CAS Name: 3-methoxy-N-[2-[5-[[(4-nitrophenyl)-oxomethyl]amino]-1,3,4-thiadiazol-2-yl]ethyl]benzamide IUPAC Name: 3-methoxy-N-[2-[5-[(4-nitrobenzoyl)amino]-1,3,4-thiadiazol-2-yl]ethyl]benzamide Traditional Name: 3-methoxy-N-[2-[5-[(4-nitrobenzoyl)amino]-1,3,4-thiadiazol-2-yl]ethyl]benzamide Formula: C19H17N5O5S MolecularWeight: 427.43378

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)NCCC2=NN=C(S2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)NCCC2=NN=C(S2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H17N5O5S/c1-29-15-4-2-3-13(11-15)17(25)20-10-9-16-22-23-19(30-16)21-18(26)12-5-7-14(8-6-12)24(27)28/h2-8,11H,9-10H2,1H3,(H,20,25)(H,21,23,26)