3,3-diethyl-2-oxidanylidene-N-(phenylmethyl)-4-pyridin-3-ylsulfanyl-azetidine-1-carboxamide

Systemtic Name: 3,3-diethyl-2-oxidanylidene-N-(phenylmethyl)-4-pyridin-3-ylsulfanyl-azetidine-1-carboxamide Openeye Name: N-benzyl-3,3-diethyl-2-oxo-4-(3-pyridylsulfanyl)azetidine-1-carboxamide CAS Name: 3,3-diethyl-2-oxo-N-(phenylmethyl)-4-(3-pyridinylthio)-1-azetidinecarboxamide IUPAC Name: N-benzyl-3,3-diethyl-2-oxo-4-pyridin-3-ylsulfanylazetidine-1-carboxamide Traditional Name: N-benzyl-3,3-diethyl-2-keto-4-(3-pyridylthio)azetidine-1-carboxamide Formula: C20H23N3O2S MolecularWeight: 369.48052

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(N(C1=O)C(=O)NCC2=CC=CC=C2)SC3=CN=CC=C3)CC

Isomeric SMILES

CCC1(C(N(C1=O)C(=O)NCC2=CC=CC=C2)SC3=CN=CC=C3)CC

InChI

InChI=1S/C20H23N3O2S/c1-3-20(4-2)17(24)23(18(20)26-16-11-8-12-21-14-16)19(25)22-13-15-9-6-5-7-10-15/h5-12,14,18H,3-4,13H2,1-2H3,(H,22,25)