tert-butyl N-[(2-chloranyl-4-oxidanylidene-6-sulfanyl-thieno[2,3-b]thiopyran-5-yl)methyl]carbamate

Systemtic Name: tert-butyl N-[(2-chloranyl-4-oxidanylidene-6-sulfanyl-thieno[2,3-b]thiopyran-5-yl)methyl]carbamate Openeye Name: tert-butyl N-[(2-chloro-4-oxo-6-sulfanyl-thieno[2,3-b]thiopyran-5-yl)methyl]carbamate CAS Name: N-[(2-chloro-6-mercapto-4-oxo-5-thieno[2,3-b]thiopyranyl)methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2-chloro-4-oxo-6-sulfanylthieno[2,3-b]thiopyran-5-yl)methyl]carbamate Traditional Name: N-[(2-chloro-4-keto-6-mercapto-thieno[2,3-b]thiopyran-5-yl)methyl]carbamic acid tert-butyl ester Formula: C13H14ClNO3S3 MolecularWeight: 363.90316

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1=C(SC2=C(C1=O)C=C(S2)Cl)S

Isomeric SMILES

CC(C)(C)OC(=O)NCC1=C(SC2=C(C1=O)C=C(S2)Cl)S

InChI

InChI=1S/C13H14ClNO3S3/c1-13(2,3)18-12(17)15-5-7-9(16)6-4-8(14)20-11(6)21-10(7)19/h4,19H,5H2,1-3H3,(H,15,17)