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

Systemtic Name: methyl 3-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-5-phenyl-thiophene-2-carboxylate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C21H14ClNO3S2 MolecularWeight: 427.92376

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H14ClNO3S2/c1-26-21(25)18-14(11-16(28-18)12-7-3-2-4-8-12)23-20(24)19-17(22)13-9-5-6-10-15(13)27-19/h2-11H,1H3,(H,23,24)