methyl 2-[3-[3-methoxy-4-(3-methylbutoxy)phenyl]prop-2-enoylamino]-5-methyl-4-phenyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[3-[3-methoxy-4-(3-methylbutoxy)phenyl]prop-2-enoylamino]-5-methyl-4-phenyl-thiophene-3-carboxylate Openeye Name: methyl 2-[3-(4-isopentyloxy-3-methoxy-phenyl)prop-2-enoylamino]-5-methyl-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[3-[3-methoxy-4-(3-methylbutoxy)phenyl]-1-oxoprop-2-enyl]amino]-5-methyl-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[3-[3-methoxy-4-(3-methylbutoxy)phenyl]prop-2-enoylamino]-5-methyl-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[3-(4-isoamoxy-3-methoxy-phenyl)acryloyl]amino]-5-methyl-4-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C28H31NO5S MolecularWeight: 493.61444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)C=CC2=CC(=C(C=C2)OCCC(C)C)OC)C(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)C=CC2=CC(=C(C=C2)OCCC(C)C)OC)C(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C28H31NO5S/c1-18(2)15-16-34-22-13-11-20(17-23(22)32-4)12-14-24(30)29-27-26(28(31)33-5)25(19(3)35-27)21-9-7-6-8-10-21/h6-14,17-18H,15-16H2,1-5H3,(H,29,30)