2-oxidanyl-N-phenyl-2-(4,5,6,7-tetrahydro-1H-1,3-diazepin-2-yl)propanethioamide

Systemtic Name: 2-oxidanyl-N-phenyl-2-(4,5,6,7-tetrahydro-1H-1,3-diazepin-2-yl)propanethioamide Openeye Name: 2-hydroxy-N-phenyl-2-(4,5,6,7-tetrahydro-1H-1,3-diazepin-2-yl)propanethioamide CAS Name: 2-hydroxy-N-phenyl-2-(4,5,6,7-tetrahydro-1H-1,3-diazepin-2-yl)propanethioamide IUPAC Name: 2-hydroxy-N-phenyl-2-(4,5,6,7-tetrahydro-1H-1,3-diazepin-2-yl)propanethioamide Traditional Name: 2-hydroxy-N-phenyl-2-(4,5,6,7-tetrahydro-1H-1,3-diazepin-2-yl)thiopropionamide Formula: C14H19N3OS MolecularWeight: 277.38516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NCCCCN1)(C(=S)NC2=CC=CC=C2)O

Isomeric SMILES

CC(C1=NCCCCN1)(C(=S)NC2=CC=CC=C2)O

InChI

InChI=1S/C14H19N3OS/c1-14(18,12-15-9-5-6-10-16-12)13(19)17-11-7-3-2-4-8-11/h2-4,7-8,18H,5-6,9-10H2,1H3,(H,15,16)(H,17,19)