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

Systemtic Name: 2-benzamido-N-(4-butylphenyl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-benzamido-N-(4-butylphenyl)-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-benzamido-N-(4-butylphenyl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-benzamido-N-(4-butylphenyl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-benzamido-N-(4-butylphenyl)-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C27H30N2O2S MolecularWeight: 446.6043

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C2=C(SC3=C2CCC(C3)C)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C2=C(SC3=C2CCC(C3)C)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H30N2O2S/c1-3-4-8-19-12-14-21(15-13-19)28-26(31)24-22-16-11-18(2)17-23(22)32-27(24)29-25(30)20-9-6-5-7-10-20/h5-7,9-10,12-15,18H,3-4,8,11,16-17H2,1-2H3,(H,28,31)(H,29,30)