(3S)-3-aminocarbonyl-2-phenyl-N-(5-propyl-1,3,4-thiadiazol-2-yl)-3,4-dihydropyrazole-5-carboximidate

Systemtic Name: (3S)-3-aminocarbonyl-2-phenyl-N-(5-propyl-1,3,4-thiadiazol-2-yl)-3,4-dihydropyrazole-5-carboximidate Openeye Name: (3S)-3-carbamoyl-2-phenyl-N-(5-propyl-1,3,4-thiadiazol-2-yl)-3,4-dihydropyrazole-5-carboximidate CAS Name: (3S)-3-carbamoyl-2-phenyl-N-(5-propyl-1,3,4-thiadiazol-2-yl)-3,4-dihydropyrazole-5-carboximidate IUPAC Name: (3S)-3-carbamoyl-2-phenyl-N-(5-propyl-1,3,4-thiadiazol-2-yl)-3,4-dihydropyrazole-5-carboximidate Traditional Name: (5S)-5-carbamoyl-1-phenyl-N-(5-propyl-1,3,4-thiadiazol-2-yl)-2-pyrazoline-3-carboximidate Formula: C16H17N6O2S- MolecularWeight: 357.41018

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(S1)N=C(C2=NN(C(C2)C(=O)N)C3=CC=CC=C3)[O-]

Isomeric SMILES

CCCC1=NN=C(S1)N=C(C2=NN([C@@H](C2)C(=O)N)C3=CC=CC=C3)[O-]

InChI

InChI=1S/C16H18N6O2S/c1-2-6-13-19-20-16(25-13)18-15(24)11-9-12(14(17)23)22(21-11)10-7-4-3-5-8-10/h3-5,7-8,12H,2,6,9H2,1H3,(H2,17,23)(H,18,20,24)/p-1/t12-/m0/s1