butyl 2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-1-benzothiophene-3-carboxylate

Systemtic Name: butyl 2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-1-benzothiophene-3-carboxylate Openeye Name: butyl 2-[(3-chlorobenzothiophene-2-carbonyl)amino]benzothiophene-3-carboxylate CAS Name: 2-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]amino]-1-benzothiophene-3-carboxylic acid butyl ester IUPAC Name: butyl 2-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-1-benzothiophene-3-carboxylate Traditional Name: 2-[(3-chlorobenzothiophene-2-carbonyl)amino]benzothiophene-3-carboxylic acid butyl ester Formula: C22H18ClNO3S2 MolecularWeight: 443.96622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(SC2=CC=CC=C21)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

CCCCOC(=O)C1=C(SC2=CC=CC=C21)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C22H18ClNO3S2/c1-2-3-12-27-22(26)17-13-8-4-6-10-15(13)29-21(17)24-20(25)19-18(23)14-9-5-7-11-16(14)28-19/h4-11H,2-3,12H2,1H3,(H,24,25)