ethyl 2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-5,6-dihydro-4H-thieno[2,3-b]thiopyran-3-carboxylate

Systemtic Name: ethyl 2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-5,6-dihydro-4H-thieno[2,3-b]thiopyran-3-carboxylate Openeye Name: ethyl 2-[(3-chlorobenzothiophene-2-carbonyl)amino]-5,6-dihydro-4H-thieno[2,3-b]thiopyran-3-carboxylate CAS Name: 2-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]amino]-5,6-dihydro-4H-thieno[2,3-b]thiopyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-5,6-dihydro-4H-thieno[2,3-b]thiopyran-3-carboxylate Traditional Name: 2-[(3-chlorobenzothiophene-2-carbonyl)amino]-5,6-dihydro-4H-thieno[2,3-b]thiopyran-3-carboxylic acid ethyl ester Formula: C19H16ClNO3S3 MolecularWeight: 437.98324

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCCS2)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCCS2)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C19H16ClNO3S3/c1-2-24-18(23)13-11-7-5-9-25-19(11)27-17(13)21-16(22)15-14(20)10-6-3-4-8-12(10)26-15/h3-4,6,8H,2,5,7,9H2,1H3,(H,21,22)