N-[3-[(4-methylsulfanylphenyl)-morpholin-4-yl-methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]benzamide

Systemtic Name: N-[3-[(4-methylsulfanylphenyl)-morpholin-4-yl-methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]benzamide Openeye Name: N-[3-[(4-methylsulfanylphenyl)-morpholino-methyl]-4,5,6,7-tetrahydrobenzothiophen-2-yl]benzamide CAS Name: N-[3-[[4-(methylthio)phenyl]-(4-morpholinyl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]benzamide IUPAC Name: N-[3-[(4-methylsulfanylphenyl)-morpholin-4-ylmethyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]benzamide Traditional Name: N-[3-[[4-(methylthio)phenyl]-morpholino-methyl]-4,5,6,7-tetrahydrobenzothiophen-2-yl]benzamide Formula: C27H30N2O2S2 MolecularWeight: 478.6693

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(C2=C(SC3=C2CCCC3)NC(=O)C4=CC=CC=C4)N5CCOCC5

Isomeric SMILES

CSC1=CC=C(C=C1)C(C2=C(SC3=C2CCCC3)NC(=O)C4=CC=CC=C4)N5CCOCC5

InChI

InChI=1S/C27H30N2O2S2/c1-32-21-13-11-19(12-14-21)25(29-15-17-31-18-16-29)24-22-9-5-6-10-23(22)33-27(24)28-26(30)20-7-3-2-4-8-20/h2-4,7-8,11-14,25H,5-6,9-10,15-18H2,1H3,(H,28,30)