methyl 2-[[5-(1-propylbenzimidazol-2-yl)thiophen-2-yl]carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: methyl 2-[[5-(1-propylbenzimidazol-2-yl)thiophen-2-yl]carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: methyl 2-[[5-(1-propylbenzimidazol-2-yl)thiophene-2-carbonyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[oxo-[5-(1-propyl-2-benzimidazolyl)-2-thiophenyl]methyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[[5-(1-propylbenzimidazol-2-yl)thiophene-2-carbonyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[[5-(1-propylbenzimidazol-2-yl)thiophene-2-carbonyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid methyl ester Formula: C25H25N3O3S2 MolecularWeight: 479.6143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2N=C1C3=CC=C(S3)C(=O)NC4=C(C5=C(S4)CCCC5)C(=O)OC

Isomeric SMILES

CCCN1C2=CC=CC=C2N=C1C3=CC=C(S3)C(=O)NC4=C(C5=C(S4)CCCC5)C(=O)OC

InChI

InChI=1S/C25H25N3O3S2/c1-3-14-28-17-10-6-5-9-16(17)26-22(28)19-12-13-20(32-19)23(29)27-24-21(25(30)31-2)15-8-4-7-11-18(15)33-24/h5-6,9-10,12-13H,3-4,7-8,11,14H2,1-2H3,(H,27,29)