2-[[(3,4-dimethylphenyl)carbamoyl-propyl-amino]methyl]-N-propyl-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[[(3,4-dimethylphenyl)carbamoyl-propyl-amino]methyl]-N-propyl-1,3-thiazole-4-carboxamide Openeye Name: 2-[[(3,4-dimethylphenyl)carbamoyl-propyl-amino]methyl]-N-propyl-thiazole-4-carboxamide CAS Name: 2-[[[(3,4-dimethylanilino)-oxomethyl]-propylamino]methyl]-N-propyl-4-thiazolecarboxamide IUPAC Name: 2-[[(3,4-dimethylphenyl)carbamoyl-propylamino]methyl]-N-propyl-1,3-thiazole-4-carboxamide Traditional Name: 2-[[(3,4-dimethylphenyl)carbamoyl-propyl-amino]methyl]-N-propyl-thiazole-4-carboxamide Formula: C20H28N4O2S MolecularWeight: 388.52692

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CSC(=N1)CN(CCC)C(=O)NC2=CC(=C(C=C2)C)C

Isomeric SMILES

CCCNC(=O)C1=CSC(=N1)CN(CCC)C(=O)NC2=CC(=C(C=C2)C)C

InChI

InChI=1S/C20H28N4O2S/c1-5-9-21-19(25)17-13-27-18(23-17)12-24(10-6-2)20(26)22-16-8-7-14(3)15(4)11-16/h7-8,11,13H,5-6,9-10,12H2,1-4H3,(H,21,25)(H,22,26)