4-[[(5-methyl-4-phenyl-1,3-thiazol-2-yl)-prop-2-enyl-amino]methyl]-N-(2-methylpropyl)benzamide

Systemtic Name: 4-[[(5-methyl-4-phenyl-1,3-thiazol-2-yl)-prop-2-enyl-amino]methyl]-N-(2-methylpropyl)benzamide Openeye Name: 4-[[allyl-(5-methyl-4-phenyl-thiazol-2-yl)amino]methyl]-N-isobutyl-benzamide CAS Name: 4-[[(5-methyl-4-phenyl-2-thiazolyl)-prop-2-enylamino]methyl]-N-(2-methylpropyl)benzamide IUPAC Name: 4-[[(5-methyl-4-phenyl-1,3-thiazol-2-yl)-prop-2-enylamino]methyl]-N-(2-methylpropyl)benzamide Traditional Name: 4-[[allyl-(5-methyl-4-phenyl-thiazol-2-yl)amino]methyl]-N-isobutyl-benzamide Formula: C25H29N3OS MolecularWeight: 419.58226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)N(CC=C)CC2=CC=C(C=C2)C(=O)NCC(C)C)C3=CC=CC=C3

Isomeric SMILES

CC1=C(N=C(S1)N(CC=C)CC2=CC=C(C=C2)C(=O)NCC(C)C)C3=CC=CC=C3

InChI

InChI=1S/C25H29N3OS/c1-5-15-28(25-27-23(19(4)30-25)21-9-7-6-8-10-21)17-20-11-13-22(14-12-20)24(29)26-16-18(2)3/h5-14,18H,1,15-17H2,2-4H3,(H,26,29)