N'-(3-aminocarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-N-[(4-propan-2-yloxyphenyl)methyl]ethanediamide

Systemtic Name: N'-(3-aminocarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-N-[(4-propan-2-yloxyphenyl)methyl]ethanediamide Openeye Name: N'-(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-N-[(4-isopropoxyphenyl)methyl]oxamide CAS Name: N'-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-N-[(4-propan-2-yloxyphenyl)methyl]oxamide IUPAC Name: N'-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-N-[(4-propan-2-yloxyphenyl)methyl]oxamide Traditional Name: N'-(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-N-(4-isopropoxybenzyl)oxamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)CNC(=O)C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)N

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)CNC(=O)C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)N

InChI

InChI=1S/C21H25N3O4S/c1-12(2)28-14-9-7-13(8-10-14)11-23-19(26)20(27)24-21-17(18(22)25)15-5-3-4-6-16(15)29-21/h7-10,12H,3-6,11H2,1-2H3,(H2,22,25)(H,23,26)(H,24,27)