2-azanylpropanamide; 3-(phenylmethylsulfanyl)bicyclo[2.2.1]hepta-1,3,5-triene

Systemtic Name: 2-azanylpropanamide; 3-(phenylmethylsulfanyl)bicyclo[2.2.1]hepta-1,3,5-triene Openeye Name: 2-aminopropanamide; 3-benzylsulfanylbicyclo[2.2.1]hepta-1,3,5-triene CAS Name: 2-aminopropanamide; 3-(phenylmethylthio)bicyclo[2.2.1]hepta-1,3,5-triene IUPAC Name: 2-aminopropanamide; 3-benzylsulfanylbicyclo[2.2.1]hepta-1,3,5-triene Traditional Name: 2-aminopropionamide; 3-(benzylthio)bicyclo[2.2.1]hepta-1,3,5-triene Formula: C17H20N2OS MolecularWeight: 300.4185

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)N.C1C2=CC(=C1C=C2)SCC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)N)N.C1C2=CC(=C1C=C2)SCC3=CC=CC=C3

InChI

InChI=1S/C14H12S.C3H8N2O/c1-2-4-11(5-3-1)10-15-14-9-12-6-7-13(14)8-12;1-2(4)3(5)6/h1-7,9H,8,10H2;2H,4H2,1H3,(H2,5,6)