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

Systemtic Name: 2-benzamido-6-methyl-N-(4-pentoxyphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-benzamido-6-methyl-N-(4-pentoxyphenyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-benzamido-6-methyl-N-(4-pentoxyphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-benzamido-6-methyl-N-(4-pentoxyphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-(4-amoxyphenyl)-2-benzamido-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C28H32N2O3S MolecularWeight: 476.63028

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)NC(=O)C2=C(SC3=C2CCC(C3)C)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)NC(=O)C2=C(SC3=C2CCC(C3)C)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C28H32N2O3S/c1-3-4-8-17-33-22-14-12-21(13-15-22)29-27(32)25-23-16-11-19(2)18-24(23)34-28(25)30-26(31)20-9-6-5-7-10-20/h5-7,9-10,12-15,19H,3-4,8,11,16-18H2,1-2H3,(H,29,32)(H,30,31)