N-[4-[(3-methylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]-2-methylsulfanyl-3-phenyl-imidazole-4-carboxamide

Systemtic Name: N-[4-[(3-methylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]-2-methylsulfanyl-3-phenyl-imidazole-4-carboxamide Openeye Name: N-[4-[(3-methyl-1-piperidyl)methyl]thiazol-2-yl]-2-methylsulfanyl-3-phenyl-imidazole-4-carboxamide CAS Name: N-[4-[(3-methyl-1-piperidinyl)methyl]-2-thiazolyl]-2-(methylthio)-3-phenyl-4-imidazolecarboxamide IUPAC Name: N-[4-[(3-methylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]-2-methylsulfanyl-3-phenylimidazole-4-carboxamide Traditional Name: N-[4-[(3-methylpiperidino)methyl]thiazol-2-yl]-2-(methylthio)-3-phenyl-imidazole-4-carboxamide Formula: C21H25N5OS2 MolecularWeight: 427.5861

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)CC2=CSC(=N2)NC(=O)C3=CN=C(N3C4=CC=CC=C4)SC

Isomeric SMILES

CC1CCCN(C1)CC2=CSC(=N2)NC(=O)C3=CN=C(N3C4=CC=CC=C4)SC

InChI

InChI=1S/C21H25N5OS2/c1-15-7-6-10-25(12-15)13-16-14-29-20(23-16)24-19(27)18-11-22-21(28-2)26(18)17-8-4-3-5-9-17/h3-5,8-9,11,14-15H,6-7,10,12-13H2,1-2H3,(H,23,24,27)