N-[2-(diethylamino)-3-methyl-butyl]-4-methyl-2-(phenylmethyl)-1,3-thiazole-5-carboxamide

Systemtic Name: N-[2-(diethylamino)-3-methyl-butyl]-4-methyl-2-(phenylmethyl)-1,3-thiazole-5-carboxamide Openeye Name: 2-benzyl-N-[2-(diethylamino)-3-methyl-butyl]-4-methyl-thiazole-5-carboxamide CAS Name: N-[2-(diethylamino)-3-methylbutyl]-4-methyl-2-(phenylmethyl)-5-thiazolecarboxamide IUPAC Name: 2-benzyl-N-[2-(diethylamino)-3-methylbutyl]-4-methyl-1,3-thiazole-5-carboxamide Traditional Name: 2-benzyl-N-[2-(diethylamino)-3-methyl-butyl]-4-methyl-thiazole-5-carboxamide Formula: C21H31N3OS MolecularWeight: 373.55534

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CNC(=O)C1=C(N=C(S1)CC2=CC=CC=C2)C)C(C)C

Isomeric SMILES

CCN(CC)C(CNC(=O)C1=C(N=C(S1)CC2=CC=CC=C2)C)C(C)C

InChI

InChI=1S/C21H31N3OS/c1-6-24(7-2)18(15(3)4)14-22-21(25)20-16(5)23-19(26-20)13-17-11-9-8-10-12-17/h8-12,15,18H,6-7,13-14H2,1-5H3,(H,22,25)