2-(1-azanyl-2-phenyl-ethyl)-N-[(3,5-dimethoxyphenyl)methyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-(1-azanyl-2-phenyl-ethyl)-N-[(3,5-dimethoxyphenyl)methyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-(1-amino-2-phenyl-ethyl)-N-[(3,5-dimethoxyphenyl)methyl]thiazole-4-carboxamide CAS Name: 2-(1-amino-2-phenylethyl)-N-[(3,5-dimethoxyphenyl)methyl]-4-thiazolecarboxamide IUPAC Name: 2-(1-amino-2-phenylethyl)-N-[(3,5-dimethoxyphenyl)methyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-(1-amino-2-phenyl-ethyl)-N-(3,5-dimethoxybenzyl)thiazole-4-carboxamide Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CNC(=O)C2=CSC(=N2)C(CC3=CC=CC=C3)N)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CNC(=O)C2=CSC(=N2)C(CC3=CC=CC=C3)N)OC

InChI

InChI=1S/C21H23N3O3S/c1-26-16-8-15(9-17(11-16)27-2)12-23-20(25)19-13-28-21(24-19)18(22)10-14-6-4-3-5-7-14/h3-9,11,13,18H,10,12,22H2,1-2H3,(H,23,25)