2-benzamido-N-(3-chloranyl-4-methyl-phenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-benzamido-N-(3-chloranyl-4-methyl-phenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-benzamido-N-(3-chloro-4-methyl-phenyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-benzamido-N-(3-chloro-4-methylphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-benzamido-N-(3-chloro-4-methylphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-benzamido-N-(3-chloro-4-methyl-phenyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C23H21ClN2O2S MolecularWeight: 424.94304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=C(SC3=C2CCCC3)NC(=O)C4=CC=CC=C4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=C(SC3=C2CCCC3)NC(=O)C4=CC=CC=C4)Cl

InChI

InChI=1S/C23H21ClN2O2S/c1-14-11-12-16(13-18(14)24)25-22(28)20-17-9-5-6-10-19(17)29-23(20)26-21(27)15-7-3-2-4-8-15/h2-4,7-8,11-13H,5-6,9-10H2,1H3,(H,25,28)(H,26,27)