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

Systemtic Name: ethyl 2-[[(4-butoxy-3-methoxy-phenyl)methylideneamino]carbamoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[[(4-butoxy-3-methoxy-phenyl)methyleneamino]carbamoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[[2-[(4-butoxy-3-methoxyphenyl)methylidene]hydrazinyl]-oxomethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(4-butoxy-3-methoxyphenyl)methylideneamino]carbamoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[[(4-butoxy-3-methoxy-benzylidene)amino]carbamoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C24H31N3O5S MolecularWeight: 473.58504

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C=NNC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)OCC)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C=NNC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)OCC)OC

InChI

InChI=1S/C24H31N3O5S/c1-4-6-13-32-18-12-11-16(14-19(18)30-3)15-25-27-24(29)26-22-21(23(28)31-5-2)17-9-7-8-10-20(17)33-22/h11-12,14-15H,4-10,13H2,1-3H3,(H2,26,27,29)