S-[2-methyl-3-[[4-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]amino]-3-oxidanylidene-propyl] ethanethioate

Systemtic Name: S-[2-methyl-3-[[4-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]amino]-3-oxidanylidene-propyl] ethanethioate Openeye Name: S-[2-methyl-3-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)anilino]-3-oxo-propyl] ethanethioate CAS Name: ethanethioic acid S-[2-methyl-3-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)anilino]-3-oxopropyl] ester IUPAC Name: S-[2-methyl-3-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)anilino]-3-oxopropyl] ethanethioate Traditional Name: ethanethioic acid S-[3-keto-3-[4-(6-keto-4-methyl-4,5-dihydro-1H-pyridazin-3-yl)anilino]-2-methyl-propyl] ester Formula: C17H21N3O3S MolecularWeight: 347.43194

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NN=C1C2=CC=C(C=C2)NC(=O)C(C)CSC(=O)C

Isomeric SMILES

CC1CC(=O)NN=C1C2=CC=C(C=C2)NC(=O)C(C)CSC(=O)C

InChI

InChI=1S/C17H21N3O3S/c1-10-8-15(22)19-20-16(10)13-4-6-14(7-5-13)18-17(23)11(2)9-24-12(3)21/h4-7,10-11H,8-9H2,1-3H3,(H,18,23)(H,19,22)