butyl 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: butyl 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: butyl 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 butyl ester IUPAC Name: butyl 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 butyl ester Formula: C18H22ClN3O3S2 MolecularWeight: 427.96858

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22ClN3O3S2/c1-2-3-10-25-16(23)12-26-15-11-13(6-7-14(15)19)20-17-21-8-4-5-9-22(21)18(24)27-17/h6-7,11H,2-5,8-10,12H2,1H3