(3-chloranyl-1-benzothiophen-2-yl)methyl 4-(thiophen-3-ylcarbonylamino)butanoate

Systemtic Name: (3-chloranyl-1-benzothiophen-2-yl)methyl 4-(thiophen-3-ylcarbonylamino)butanoate Openeye Name: (3-chlorobenzothiophen-2-yl)methyl 4-(thiophene-3-carbonylamino)butanoate CAS Name: 4-[[oxo(3-thiophenyl)methyl]amino]butanoic acid (3-chloro-1-benzothiophen-2-yl)methyl ester IUPAC Name: (3-chloro-1-benzothiophen-2-yl)methyl 4-(thiophene-3-carbonylamino)butanoate Traditional Name: 4-(3-thenoylamino)butyric acid (3-chlorobenzothiophen-2-yl)methyl ester Formula: C18H16ClNO3S2 MolecularWeight: 393.90754

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)COC(=O)CCCNC(=O)C3=CSC=C3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)COC(=O)CCCNC(=O)C3=CSC=C3)Cl

InChI

InChI=1S/C18H16ClNO3S2/c19-17-13-4-1-2-5-14(13)25-15(17)10-23-16(21)6-3-8-20-18(22)12-7-9-24-11-12/h1-2,4-5,7,9,11H,3,6,8,10H2,(H,20,22)