methyl 3-chloranyl-6-[(2,6-dimethylmorpholin-4-yl)carbothioylamino]-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 3-chloranyl-6-[(2,6-dimethylmorpholin-4-yl)carbothioylamino]-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-chloro-6-[(2,6-dimethylmorpholine-4-carbothioyl)amino]benzothiophene-2-carboxylate CAS Name: 3-chloro-6-[[(2,6-dimethyl-4-morpholinyl)-sulfanylidenemethyl]amino]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-chloro-6-[(2,6-dimethylmorpholine-4-carbothioyl)amino]-1-benzothiophene-2-carboxylate Traditional Name: 3-chloro-6-[(2,6-dimethylmorpholine-4-carbothioyl)amino]benzothiophene-2-carboxylic acid methyl ester Formula: C17H19ClN2O3S2 MolecularWeight: 398.92736

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)C(=S)NC2=CC3=C(C=C2)C(=C(S3)C(=O)OC)Cl

Isomeric SMILES

CC1CN(CC(O1)C)C(=S)NC2=CC3=C(C=C2)C(=C(S3)C(=O)OC)Cl

InChI

InChI=1S/C17H19ClN2O3S2/c1-9-7-20(8-10(2)23-9)17(24)19-11-4-5-12-13(6-11)25-15(14(12)18)16(21)22-3/h4-6,9-10H,7-8H2,1-3H3,(H,19,24)