ethyl 4-[[[2-[2-(3,4-dimethoxyphenyl)ethyl-[(5-methylthiophen-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-(3-ethoxypropyl)carbamoyl]amino]benzoate

Systemtic Name: ethyl 4-[[[2-[2-(3,4-dimethoxyphenyl)ethyl-[(5-methylthiophen-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-(3-ethoxypropyl)carbamoyl]amino]benzoate Openeye Name: ethyl 4-[[[2-[2-(3,4-dimethoxyphenyl)ethyl-[(5-methyl-2-thienyl)methyl]amino]-2-oxo-ethyl]-(3-ethoxypropyl)carbamoyl]amino]benzoate CAS Name: 4-[[[[2-[2-(3,4-dimethoxyphenyl)ethyl-[(5-methyl-2-thiophenyl)methyl]amino]-2-oxoethyl]-(3-ethoxypropyl)amino]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[[2-[2-(3,4-dimethoxyphenyl)ethyl-[(5-methylthiophen-2-yl)methyl]amino]-2-oxoethyl]-(3-ethoxypropyl)carbamoyl]amino]benzoate Traditional Name: 4-[[3-ethoxypropyl-[2-[homoveratryl-[(5-methyl-2-thienyl)methyl]amino]-2-keto-ethyl]carbamoyl]amino]benzoic acid ethyl ester Formula: C33H43N3O7S MolecularWeight: 625.77542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN(CC(=O)N(CCC1=CC(=C(C=C1)OC)OC)CC2=CC=C(S2)C)C(=O)NC3=CC=C(C=C3)C(=O)OCC

Isomeric SMILES

CCOCCCN(CC(=O)N(CCC1=CC(=C(C=C1)OC)OC)CC2=CC=C(S2)C)C(=O)NC3=CC=C(C=C3)C(=O)OCC

InChI

InChI=1S/C33H43N3O7S/c1-6-42-20-8-18-36(33(39)34-27-13-11-26(12-14-27)32(38)43-7-2)23-31(37)35(22-28-15-9-24(3)44-28)19-17-25-10-16-29(40-4)30(21-25)41-5/h9-16,21H,6-8,17-20,22-23H2,1-5H3,(H,34,39)