methyl 4-[butanoyl-[(3-oxidanylidene-1-benzothiophen-2-ylidene)methyl]amino]benzoate

Systemtic Name: methyl 4-[butanoyl-[(3-oxidanylidene-1-benzothiophen-2-ylidene)methyl]amino]benzoate Openeye Name: methyl 4-[butanoyl-[(3-oxobenzothiophen-2-ylidene)methyl]amino]benzoate CAS Name: 4-[(3-oxo-1-benzothiophen-2-ylidene)methyl-(1-oxobutyl)amino]benzoic acid methyl ester IUPAC Name: methyl 4-[butanoyl-[(3-oxo-1-benzothiophen-2-ylidene)methyl]amino]benzoate Traditional Name: 4-[butyryl-[(3-ketobenzothiophen-2-ylidene)methyl]amino]benzoic acid methyl ester Formula: C21H19NO4S MolecularWeight: 381.44486

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N(C=C1C(=O)C2=CC=CC=C2S1)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCCC(=O)N(C=C1C(=O)C2=CC=CC=C2S1)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C21H19NO4S/c1-3-6-19(23)22(15-11-9-14(10-12-15)21(25)26-2)13-18-20(24)16-7-4-5-8-17(16)27-18/h4-5,7-13H,3,6H2,1-2H3