N-[2-[2-(3,4-dimethoxyphenyl)ethyl-[(3-methylthiophen-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide

Systemtic Name: N-[2-[2-(3,4-dimethoxyphenyl)ethyl-[(3-methylthiophen-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide Openeye Name: N-[2-[2-(3,4-dimethoxyphenyl)ethyl-[(3-methyl-2-thienyl)methyl]amino]-2-oxo-ethyl]-N-isobutyl-3,3-dimethyl-butanamide CAS Name: N-[2-[2-(3,4-dimethoxyphenyl)ethyl-[(3-methyl-2-thiophenyl)methyl]amino]-2-oxoethyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide IUPAC Name: N-[2-[2-(3,4-dimethoxyphenyl)ethyl-[(3-methylthiophen-2-yl)methyl]amino]-2-oxoethyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide Traditional Name: N-[2-[homoveratryl-[(3-methyl-2-thienyl)methyl]amino]-2-keto-ethyl]-N-isobutyl-3,3-dimethyl-butyramide Formula: C28H42N2O4S MolecularWeight: 502.70908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CN(CCC2=CC(=C(C=C2)OC)OC)C(=O)CN(CC(C)C)C(=O)CC(C)(C)C

Isomeric SMILES

CC1=C(SC=C1)CN(CCC2=CC(=C(C=C2)OC)OC)C(=O)CN(CC(C)C)C(=O)CC(C)(C)C

InChI

InChI=1S/C28H42N2O4S/c1-20(2)17-30(26(31)16-28(4,5)6)19-27(32)29(18-25-21(3)12-14-35-25)13-11-22-9-10-23(33-7)24(15-22)34-8/h9-10,12,14-15,20H,11,13,16-19H2,1-8H3