2-cyclopropylethanoyl-[4-(6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]carbamothioic S-acid

Systemtic Name: 2-cyclopropylethanoyl-[4-(6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]carbamothioic S-acid Openeye Name: (2-cyclopropylacetyl)-[4-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]carbamothioic S-acid CAS Name: (2-cyclopropyl-1-oxoethyl)-[4-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]carbamothioic S-acid IUPAC Name: (2-cyclopropylacetyl)-[4-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]carbamothioic S-acid Traditional Name: (2-cyclopropylacetyl)-[4-(6-keto-4,5-dihydro-1H-pyridazin-3-yl)phenyl]thiocarbamic S-acid Formula: C16H17N3O3S MolecularWeight: 331.38948

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CC(=O)N(C2=CC=C(C=C2)C3=NNC(=O)CC3)C(=O)S

Isomeric SMILES

C1CC1CC(=O)N(C2=CC=C(C=C2)C3=NNC(=O)CC3)C(=O)S

InChI

InChI=1S/C16H17N3O3S/c20-14-8-7-13(17-18-14)11-3-5-12(6-4-11)19(16(22)23)15(21)9-10-1-2-10/h3-6,10H,1-2,7-9H2,(H,18,20)(H,22,23)