2-(1,3-benzoxazol-2-ylmethylsulfanyl)-4-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile

Systemtic Name: 2-(1,3-benzoxazol-2-ylmethylsulfanyl)-4-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile Openeye Name: 2-(1,3-benzoxazol-2-ylmethylsulfanyl)-4-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile CAS Name: 2-(1,3-benzoxazol-2-ylmethylthio)-4-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile IUPAC Name: 2-(1,3-benzoxazol-2-ylmethylsulfanyl)-4-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile Traditional Name: 2-(1,3-benzoxazol-2-ylmethylthio)-4-methyl-1-pyrindan-3-carbonitrile Formula: C18H15N3OS MolecularWeight: 321.3962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=C1CCC2)SCC3=NC4=CC=CC=C4O3)C#N

Isomeric SMILES

CC1=C(C(=NC2=C1CCC2)SCC3=NC4=CC=CC=C4O3)C#N

InChI

InChI=1S/C18H15N3OS/c1-11-12-5-4-7-14(12)21-18(13(11)9-19)23-10-17-20-15-6-2-3-8-16(15)22-17/h2-3,6,8H,4-5,7,10H2,1H3