[4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]piperidin-1-yl]-(2-methoxy-4-methylsulfanyl-phenyl)methanone

Systemtic Name: [4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]piperidin-1-yl]-(2-methoxy-4-methylsulfanyl-phenyl)methanone Openeye Name: [4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]-1-piperidyl]-(2-methoxy-4-methylsulfanyl-phenyl)methanone CAS Name: [4-[1-(1-benzotriazolylmethyl)-2-imidazolyl]-1-piperidinyl]-[2-methoxy-4-(methylthio)phenyl]methanone IUPAC Name: [4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]piperidin-1-yl]-(2-methoxy-4-methylsulfanylphenyl)methanone Traditional Name: [4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]piperidino]-[2-methoxy-4-(methylthio)phenyl]methanone Formula: C24H26N6O2S MolecularWeight: 462.56724

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)SC)C(=O)N2CCC(CC2)C3=NC=CN3CN4C5=CC=CC=C5N=N4

Isomeric SMILES

COC1=C(C=CC(=C1)SC)C(=O)N2CCC(CC2)C3=NC=CN3CN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C24H26N6O2S/c1-32-22-15-18(33-2)7-8-19(22)24(31)28-12-9-17(10-13-28)23-25-11-14-29(23)16-30-21-6-4-3-5-20(21)26-27-30/h3-8,11,14-15,17H,9-10,12-13,16H2,1-2H3