N-[5-(2-morpholin-4-ylethylamino)-1,3,4-thiadiazol-2-yl]-3-nitro-benzamide

Systemtic Name: N-[5-(2-morpholin-4-ylethylamino)-1,3,4-thiadiazol-2-yl]-3-nitro-benzamide Openeye Name: N-[5-(2-morpholinoethylamino)-1,3,4-thiadiazol-2-yl]-3-nitro-benzamide CAS Name: N-[5-[2-(4-morpholinyl)ethylamino]-1,3,4-thiadiazol-2-yl]-3-nitrobenzamide IUPAC Name: N-[5-(2-morpholin-4-ylethylamino)-1,3,4-thiadiazol-2-yl]-3-nitrobenzamide Traditional Name: N-[5-(2-morpholinoethylamino)-1,3,4-thiadiazol-2-yl]-3-nitro-benzamide Formula: C15H18N6O4S MolecularWeight: 378.40622

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCNC2=NN=C(S2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1CCNC2=NN=C(S2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H18N6O4S/c22-13(11-2-1-3-12(10-11)21(23)24)17-15-19-18-14(26-15)16-4-5-20-6-8-25-9-7-20/h1-3,10H,4-9H2,(H,16,18)(H,17,19,22)