(4-cyclobutyl-1,4-diazepan-1-yl)-(5-phenylsulfanylpyridin-2-yl)methanone

Systemtic Name: (4-cyclobutyl-1,4-diazepan-1-yl)-(5-phenylsulfanylpyridin-2-yl)methanone Openeye Name: (4-cyclobutyl-1,4-diazepan-1-yl)-(5-phenylsulfanyl-2-pyridyl)methanone CAS Name: (4-cyclobutyl-1,4-diazepan-1-yl)-[5-(phenylthio)-2-pyridinyl]methanone IUPAC Name: (4-cyclobutyl-1,4-diazepan-1-yl)-(5-phenylsulfanylpyridin-2-yl)methanone Traditional Name: (4-cyclobutyl-1,4-diazepan-1-yl)-[5-(phenylthio)-2-pyridyl]methanone Formula: C21H25N3OS MolecularWeight: 367.5077

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)N2CCCN(CC2)C(=O)C3=NC=C(C=C3)SC4=CC=CC=C4

Isomeric SMILES

C1CC(C1)N2CCCN(CC2)C(=O)C3=NC=C(C=C3)SC4=CC=CC=C4

InChI

InChI=1S/C21H25N3OS/c25-21(24-13-5-12-23(14-15-24)17-6-4-7-17)20-11-10-19(16-22-20)26-18-8-2-1-3-9-18/h1-3,8-11,16-17H,4-7,12-15H2