N-[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]-4-methyl-2-(phenylmethyl)-1,3-thiazole-5-carboxamide

Systemtic Name: N-[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]-4-methyl-2-(phenylmethyl)-1,3-thiazole-5-carboxamide Openeye Name: 2-benzyl-N-[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]-4-methyl-thiazole-5-carboxamide CAS Name: N-[4-(4-ethyl-1-piperazinyl)-3-methylphenyl]-4-methyl-2-(phenylmethyl)-5-thiazolecarboxamide IUPAC Name: 2-benzyl-N-[4-(4-ethylpiperazin-1-yl)-3-methylphenyl]-4-methyl-1,3-thiazole-5-carboxamide Traditional Name: 2-benzyl-N-[4-(4-ethylpiperazino)-3-methyl-phenyl]-4-methyl-thiazole-5-carboxamide Formula: C25H30N4OS MolecularWeight: 434.5969

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=C(N=C(S3)CC4=CC=CC=C4)C)C

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=C(N=C(S3)CC4=CC=CC=C4)C)C

InChI

InChI=1S/C25H30N4OS/c1-4-28-12-14-29(15-13-28)22-11-10-21(16-18(22)2)27-25(30)24-19(3)26-23(31-24)17-20-8-6-5-7-9-20/h5-11,16H,4,12-15,17H2,1-3H3,(H,27,30)