[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]-(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)methanone

Systemtic Name: [3-(1,3-benzoxazol-2-yl)piperidin-1-yl]-(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)methanone Openeye Name: [3-(1,3-benzoxazol-2-yl)-1-piperidyl]-(5-chloro-2-methylsulfanyl-pyrimidin-4-yl)methanone CAS Name: [3-(1,3-benzoxazol-2-yl)-1-piperidinyl]-[5-chloro-2-(methylthio)-4-pyrimidinyl]methanone IUPAC Name: [3-(1,3-benzoxazol-2-yl)piperidin-1-yl]-(5-chloro-2-methylsulfanylpyrimidin-4-yl)methanone Traditional Name: [3-(1,3-benzoxazol-2-yl)piperidino]-[5-chloro-2-(methylthio)pyrimidin-4-yl]methanone Formula: C18H17ClN4O2S MolecularWeight: 388.87118

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)C(=O)N2CCCC(C2)C3=NC4=CC=CC=C4O3)Cl

Isomeric SMILES

CSC1=NC=C(C(=N1)C(=O)N2CCCC(C2)C3=NC4=CC=CC=C4O3)Cl

InChI

InChI=1S/C18H17ClN4O2S/c1-26-18-20-9-12(19)15(22-18)17(24)23-8-4-5-11(10-23)16-21-13-6-2-3-7-14(13)25-16/h2-3,6-7,9,11H,4-5,8,10H2,1H3