N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(2,3-dimethylphenyl)carbamoyl-propan-2-yl-amino]-N-[(5-methylthiophen-2-yl)methyl]ethanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(2,3-dimethylphenyl)carbamoyl-propan-2-yl-amino]-N-[(5-methylthiophen-2-yl)methyl]ethanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(2,3-dimethylphenyl)carbamoyl-isopropyl-amino]-N-[(5-methyl-2-thienyl)methyl]acetamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[[(2,3-dimethylanilino)-oxomethyl]-propan-2-ylamino]-N-[(5-methyl-2-thiophenyl)methyl]acetamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(2,3-dimethylphenyl)carbamoyl-propan-2-ylamino]-N-[(5-methylthiophen-2-yl)methyl]acetamide Traditional Name: 2-[(2,3-dimethylphenyl)carbamoyl-isopropyl-amino]-N-homoveratryl-N-[(5-methyl-2-thienyl)methyl]acetamide Formula: C30H39N3O4S MolecularWeight: 537.71336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)N(CC(=O)N(CCC2=CC(=C(C=C2)OC)OC)CC3=CC=C(S3)C)C(C)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)N(CC(=O)N(CCC2=CC(=C(C=C2)OC)OC)CC3=CC=C(S3)C)C(C)C)C

InChI

InChI=1S/C30H39N3O4S/c1-20(2)33(30(35)31-26-10-8-9-21(3)23(26)5)19-29(34)32(18-25-13-11-22(4)38-25)16-15-24-12-14-27(36-6)28(17-24)37-7/h8-14,17,20H,15-16,18-19H2,1-7H3,(H,31,35)