N-butyl-2-[[butyl-(2-methylphenyl)carbonyl-amino]methyl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-butyl-2-[[butyl-(2-methylphenyl)carbonyl-amino]methyl]-1,3-thiazole-4-carboxamide Openeye Name: N-butyl-2-[[butyl-(2-methylbenzoyl)amino]methyl]thiazole-4-carboxamide CAS Name: N-butyl-2-[[butyl-[(2-methylphenyl)-oxomethyl]amino]methyl]-4-thiazolecarboxamide IUPAC Name: N-butyl-2-[[butyl-(2-methylbenzoyl)amino]methyl]-1,3-thiazole-4-carboxamide Traditional Name: N-butyl-2-[[butyl(o-toluoyl)amino]methyl]thiazole-4-carboxamide Formula: C21H29N3O2S MolecularWeight: 387.53886

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CSC(=N1)CN(CCCC)C(=O)C2=CC=CC=C2C

Isomeric SMILES

CCCCNC(=O)C1=CSC(=N1)CN(CCCC)C(=O)C2=CC=CC=C2C

InChI

InChI=1S/C21H29N3O2S/c1-4-6-12-22-20(25)18-15-27-19(23-18)14-24(13-7-5-2)21(26)17-11-9-8-10-16(17)3/h8-11,15H,4-7,12-14H2,1-3H3,(H,22,25)