methyl 2-[[(3-methoxy-4-phenylmethoxy-phenyl)methylideneamino]carbamoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: methyl 2-[[(3-methoxy-4-phenylmethoxy-phenyl)methylideneamino]carbamoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: methyl 2-[[(4-benzyloxy-3-methoxy-phenyl)methyleneamino]carbamoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[[2-[(3-methoxy-4-phenylmethoxyphenyl)methylidene]hydrazinyl]-oxomethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[[(3-methoxy-4-phenylmethoxyphenyl)methylideneamino]carbamoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[[(4-benzoxy-3-methoxy-benzylidene)amino]carbamoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid methyl ester Formula: C26H27N3O5S MolecularWeight: 493.57468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NNC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)OC)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)C=NNC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)OC)OCC4=CC=CC=C4

InChI

InChI=1S/C26H27N3O5S/c1-32-21-14-18(12-13-20(21)34-16-17-8-4-3-5-9-17)15-27-29-26(31)28-24-23(25(30)33-2)19-10-6-7-11-22(19)35-24/h3-5,8-9,12-15H,6-7,10-11,16H2,1-2H3,(H2,28,29,31)