2-[(5-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-N-[3-(2-methylpiperidin-1-yl)propyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[(5-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-N-[3-(2-methylpiperidin-1-yl)propyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-[(5-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-N-[3-(2-methyl-1-piperidyl)propyl]thiazole-4-carboxamide CAS Name: 2-[[(5-methyl-1,3-benzoxazol-2-yl)thio]methyl]-N-[3-(2-methyl-1-piperidinyl)propyl]-4-thiazolecarboxamide IUPAC Name: 2-[(5-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-N-[3-(2-methylpiperidin-1-yl)propyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-[[(5-methyl-1,3-benzoxazol-2-yl)thio]methyl]-N-[3-(2-methylpiperidino)propyl]thiazole-4-carboxamide Formula: C22H28N4O2S2 MolecularWeight: 444.61332

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1CCCNC(=O)C2=CSC(=N2)CSC3=NC4=C(O3)C=CC(=C4)C

Isomeric SMILES

CC1CCCCN1CCCNC(=O)C2=CSC(=N2)CSC3=NC4=C(O3)C=CC(=C4)C

InChI

InChI=1S/C22H28N4O2S2/c1-15-7-8-19-17(12-15)25-22(28-19)30-14-20-24-18(13-29-20)21(27)23-9-5-11-26-10-4-3-6-16(26)2/h7-8,12-13,16H,3-6,9-11,14H2,1-2H3,(H,23,27)