ethyl 2-[2-chloranyl-5-[(3-oxidanylidene-5,6,7,8-tetrahydro-[1,3,4]thiadiazolo[3,4-a]pyridazin-1-ylidene)amino]phenyl]sulfanylethanoate

Systemtic Name: ethyl 2-[2-chloranyl-5-[(3-oxidanylidene-5,6,7,8-tetrahydro-[1,3,4]thiadiazolo[3,4-a]pyridazin-1-ylidene)amino]phenyl]sulfanylethanoate Openeye Name: ethyl 2-[2-chloro-5-[(3-oxo-5,6,7,8-tetrahydro-[1,3,4]thiadiazolo[3,4-a]pyridazin-1-ylidene)amino]phenyl]sulfanylacetate CAS Name: 2-[[2-chloro-5-[(3-oxo-5,6,7,8-tetrahydro-[1,3,4]thiadiazolo[3,4-a]pyridazin-1-ylidene)amino]phenyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-chloro-5-[(3-oxo-5,6,7,8-tetrahydro-[1,3,4]thiadiazolo[3,4-a]pyridazin-1-ylidene)amino]phenyl]sulfanylacetate Traditional Name: 2-[[2-chloro-5-[(3-keto-5,6,7,8-tetrahydro-[1,3,4]thiadiazolo[3,4-a]pyridazin-1-ylidene)amino]phenyl]thio]acetic acid ethyl ester Formula: C16H18ClN3O3S2 MolecularWeight: 399.91542

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=C(C=CC(=C1)N=C2N3CCCCN3C(=O)S2)Cl

Isomeric SMILES

CCOC(=O)CSC1=C(C=CC(=C1)N=C2N3CCCCN3C(=O)S2)Cl

InChI

InChI=1S/C16H18ClN3O3S2/c1-2-23-14(21)10-24-13-9-11(5-6-12(13)17)18-15-19-7-3-4-8-20(19)16(22)25-15/h5-6,9H,2-4,7-8,10H2,1H3