N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(3-methylphenyl)carbamoyl-prop-2-enyl-amino]-N-[(3-methylthiophen-2-yl)methyl]ethanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(3-methylphenyl)carbamoyl-prop-2-enyl-amino]-N-[(3-methylthiophen-2-yl)methyl]ethanamide Openeye Name: 2-[allyl(m-tolylcarbamoyl)amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(3-methyl-2-thienyl)methyl]acetamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[[(3-methylanilino)-oxomethyl]-prop-2-enylamino]-N-[(3-methyl-2-thiophenyl)methyl]acetamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(3-methylphenyl)carbamoyl-prop-2-enylamino]-N-[(3-methylthiophen-2-yl)methyl]acetamide Traditional Name: 2-[allyl(m-tolylcarbamoyl)amino]-N-homoveratryl-N-[(3-methyl-2-thienyl)methyl]acetamide Formula: C29H35N3O4S MolecularWeight: 521.6709

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)N(CC=C)CC(=O)N(CCC2=CC(=C(C=C2)OC)OC)CC3=C(C=CS3)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)N(CC=C)CC(=O)N(CCC2=CC(=C(C=C2)OC)OC)CC3=C(C=CS3)C

InChI

InChI=1S/C29H35N3O4S/c1-6-14-32(29(34)30-24-9-7-8-21(2)17-24)20-28(33)31(19-27-22(3)13-16-37-27)15-12-23-10-11-25(35-4)26(18-23)36-5/h6-11,13,16-18H,1,12,14-15,19-20H2,2-5H3,(H,30,34)