azepan-1-yl-[1-[2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]pyridin-3-yl]carbonylpiperidin-4-yl]methanone

Systemtic Name: azepan-1-yl-[1-[2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]pyridin-3-yl]carbonylpiperidin-4-yl]methanone Openeye Name: azepan-1-yl-[1-[2-[(5-methylisoxazol-3-yl)methylsulfanyl]pyridine-3-carbonyl]-4-piperidyl]methanone CAS Name: 1-azepanyl-[1-[[2-[(5-methyl-3-isoxazolyl)methylthio]-3-pyridinyl]-oxomethyl]-4-piperidinyl]methanone IUPAC Name: azepan-1-yl-[1-[2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]pyridine-3-carbonyl]piperidin-4-yl]methanone Traditional Name: azepan-1-yl-[1-[2-[(5-methylisoxazol-3-yl)methylthio]nicotinoyl]-4-piperidyl]methanone Formula: C23H30N4O3S MolecularWeight: 442.5743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CSC2=C(C=CC=N2)C(=O)N3CCC(CC3)C(=O)N4CCCCCC4

Isomeric SMILES

CC1=CC(=NO1)CSC2=C(C=CC=N2)C(=O)N3CCC(CC3)C(=O)N4CCCCCC4

InChI

InChI=1S/C23H30N4O3S/c1-17-15-19(25-30-17)16-31-21-20(7-6-10-24-21)23(29)27-13-8-18(9-14-27)22(28)26-11-4-2-3-5-12-26/h6-7,10,15,18H,2-5,8-9,11-14,16H2,1H3