2-[2-[cyclobutylcarbonyl(thiophen-2-ylmethyl)amino]ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-[2-[cyclobutylcarbonyl(thiophen-2-ylmethyl)amino]ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[[2-[cyclobutanecarbonyl(2-thienylmethyl)amino]acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[2-[[cyclobutyl(oxo)methyl]-(thiophen-2-ylmethyl)amino]-1-oxoethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[[2-[cyclobutanecarbonyl(thiophen-2-ylmethyl)amino]acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[[2-[cyclobutanecarbonyl(2-thenyl)amino]acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C21H25N3O3S2 MolecularWeight: 431.5715

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)CN(CC3=CC=CS3)C(=O)C4CCC4)C(=O)N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)CN(CC3=CC=CS3)C(=O)C4CCC4)C(=O)N

InChI

InChI=1S/C21H25N3O3S2/c22-19(26)18-15-8-1-2-9-16(15)29-20(18)23-17(25)12-24(11-14-7-4-10-28-14)21(27)13-5-3-6-13/h4,7,10,13H,1-3,5-6,8-9,11-12H2,(H2,22,26)(H,23,25)