N-[3-[(4-methylphenyl)-morpholin-4-yl-methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]furan-2-carboxamide

Systemtic Name: N-[3-[(4-methylphenyl)-morpholin-4-yl-methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]furan-2-carboxamide Openeye Name: N-[3-[morpholino(p-tolyl)methyl]-4,5,6,7-tetrahydrobenzothiophen-2-yl]furan-2-carboxamide CAS Name: N-[3-[(4-methylphenyl)-(4-morpholinyl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-furancarboxamide IUPAC Name: N-[3-[(4-methylphenyl)-morpholin-4-ylmethyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]furan-2-carboxamide Traditional Name: N-[3-[morpholino(p-tolyl)methyl]-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-furamide Formula: C25H28N2O3S MolecularWeight: 436.56642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=C(SC3=C2CCCC3)NC(=O)C4=CC=CO4)N5CCOCC5

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=C(SC3=C2CCCC3)NC(=O)C4=CC=CO4)N5CCOCC5

InChI

InChI=1S/C25H28N2O3S/c1-17-8-10-18(11-9-17)23(27-12-15-29-16-13-27)22-19-5-2-3-7-21(19)31-25(22)26-24(28)20-6-4-14-30-20/h4,6,8-11,14,23H,2-3,5,7,12-13,15-16H2,1H3,(H,26,28)