N-(2-methylpropyl)-N-[2-[(3-methylthiophen-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]hexanamide

Systemtic Name: N-(2-methylpropyl)-N-[2-[(3-methylthiophen-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]hexanamide Openeye Name: N-[2-[benzyl-[(3-methyl-2-thienyl)methyl]amino]-2-oxo-ethyl]-N-isobutyl-hexanamide CAS Name: N-(2-methylpropyl)-N-[2-[(3-methyl-2-thiophenyl)methyl-(phenylmethyl)amino]-2-oxoethyl]hexanamide IUPAC Name: N-[2-[benzyl-[(3-methylthiophen-2-yl)methyl]amino]-2-oxoethyl]-N-(2-methylpropyl)hexanamide Traditional Name: N-[2-[benzyl-[(3-methyl-2-thienyl)methyl]amino]-2-keto-ethyl]-N-isobutyl-hexanamide Formula: C25H36N2O2S MolecularWeight: 428.63054

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)N(CC(C)C)CC(=O)N(CC1=CC=CC=C1)CC2=C(C=CS2)C

Isomeric SMILES

CCCCCC(=O)N(CC(C)C)CC(=O)N(CC1=CC=CC=C1)CC2=C(C=CS2)C

InChI

InChI=1S/C25H36N2O2S/c1-5-6-8-13-24(28)26(16-20(2)3)19-25(29)27(17-22-11-9-7-10-12-22)18-23-21(4)14-15-30-23/h7,9-12,14-15,20H,5-6,8,13,16-19H2,1-4H3