2-[[(2,4-dimethoxyphenyl)methyl-(1-phenylethyl)amino]methyl]-N-pentyl-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[[(2,4-dimethoxyphenyl)methyl-(1-phenylethyl)amino]methyl]-N-pentyl-1,3-thiazole-4-carboxamide Openeye Name: 2-[[(2,4-dimethoxyphenyl)methyl-(1-phenylethyl)amino]methyl]-N-pentyl-thiazole-4-carboxamide CAS Name: 2-[[(2,4-dimethoxyphenyl)methyl-(1-phenylethyl)amino]methyl]-N-pentyl-4-thiazolecarboxamide IUPAC Name: 2-[[(2,4-dimethoxyphenyl)methyl-(1-phenylethyl)amino]methyl]-N-pentyl-1,3-thiazole-4-carboxamide Traditional Name: N-amyl-2-[[(2,4-dimethoxybenzyl)-(1-phenylethyl)amino]methyl]thiazole-4-carboxamide Formula: C27H35N3O3S MolecularWeight: 481.6501

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C1=CSC(=N1)CN(CC2=C(C=C(C=C2)OC)OC)C(C)C3=CC=CC=C3

Isomeric SMILES

CCCCCNC(=O)C1=CSC(=N1)CN(CC2=C(C=C(C=C2)OC)OC)C(C)C3=CC=CC=C3

InChI

InChI=1S/C27H35N3O3S/c1-5-6-10-15-28-27(31)24-19-34-26(29-24)18-30(20(2)21-11-8-7-9-12-21)17-22-13-14-23(32-3)16-25(22)33-4/h7-9,11-14,16,19-20H,5-6,10,15,17-18H2,1-4H3,(H,28,31)