N-[(6S)-3-aminocarbonyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3-(methoxymethyl)-1-benzofuran-2-carboxamide

Systemtic Name: N-[(6S)-3-aminocarbonyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3-(methoxymethyl)-1-benzofuran-2-carboxamide Openeye Name: N-[(6S)-3-carbamoyl-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-3-(methoxymethyl)benzofuran-2-carboxamide CAS Name: N-[(6S)-3-carbamoyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3-(methoxymethyl)-2-benzofurancarboxamide IUPAC Name: N-[(6S)-3-carbamoyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3-(methoxymethyl)-1-benzofuran-2-carboxamide Traditional Name: N-[(6S)-3-carbamoyl-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-3-(methoxymethyl)coumarilamide Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=C(C4=CC=CC=C4O3)COC

Isomeric SMILES

C[C@H]1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=C(C4=CC=CC=C4O3)COC

InChI

InChI=1S/C21H22N2O4S/c1-11-7-8-13-16(9-11)28-21(17(13)19(22)24)23-20(25)18-14(10-26-2)12-5-3-4-6-15(12)27-18/h3-6,11H,7-10H2,1-2H3,(H2,22,24)(H,23,25)/t11-/m0/s1