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

Systemtic Name: 2-benzamido-N-(2-hydroxyethyl)-N-(phenylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-benzamido-N-benzyl-N-(2-hydroxyethyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-benzamido-N-(2-hydroxyethyl)-N-(phenylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-benzamido-N-benzyl-N-(2-hydroxyethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-benzamido-N-benzyl-N-(2-hydroxyethyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C25H26N2O3S MolecularWeight: 434.55054

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=CC=C3)C(=O)N(CCO)CC4=CC=CC=C4

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=CC=C3)C(=O)N(CCO)CC4=CC=CC=C4

InChI

InChI=1S/C25H26N2O3S/c28-16-15-27(17-18-9-3-1-4-10-18)25(30)22-20-13-7-8-14-21(20)31-24(22)26-23(29)19-11-5-2-6-12-19/h1-6,9-12,28H,7-8,13-17H2,(H,26,29)