ethyl 3-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-5-phenyl-thiophene-2-carboxylate

Systemtic Name: ethyl 3-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-5-phenyl-thiophene-2-carboxylate Openeye Name: ethyl 3-[(3-chlorobenzothiophene-2-carbonyl)amino]-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]amino]-5-phenyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-5-phenylthiophene-2-carboxylate Traditional Name: 3-[(3-chlorobenzothiophene-2-carbonyl)amino]-5-phenyl-thiophene-2-carboxylic acid ethyl ester Formula: C22H16ClNO3S2 MolecularWeight: 441.95034

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C22H16ClNO3S2/c1-2-27-22(26)19-15(12-17(29-19)13-8-4-3-5-9-13)24-21(25)20-18(23)14-10-6-7-11-16(14)28-20/h3-12H,2H2,1H3,(H,24,25)