2-methylpropyl 4-[(1-chloranylbenzo[e][1]benzothiol-2-yl)carbonylamino]benzoate

Systemtic Name: 2-methylpropyl 4-[(1-chloranylbenzo[e][1]benzothiol-2-yl)carbonylamino]benzoate Openeye Name: isobutyl 4-[(1-chlorobenzo[e]benzothiophene-2-carbonyl)amino]benzoate CAS Name: 4-[[(1-chloro-2-benzo[e][1]benzothiolyl)-oxomethyl]amino]benzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-[(1-chlorobenzo[e][1]benzothiole-2-carbonyl)amino]benzoate Traditional Name: 4-[(1-chlorobenzo[e]benzothiophene-2-carbonyl)amino]benzoic acid isobutyl ester Formula: C24H20ClNO3S MolecularWeight: 437.9385

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C3=C(S2)C=CC4=CC=CC=C43)Cl

Isomeric SMILES

CC(C)COC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C3=C(S2)C=CC4=CC=CC=C43)Cl

InChI

InChI=1S/C24H20ClNO3S/c1-14(2)13-29-24(28)16-7-10-17(11-8-16)26-23(27)22-21(25)20-18-6-4-3-5-15(18)9-12-19(20)30-22/h3-12,14H,13H2,1-2H3,(H,26,27)