2-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl-methyl-amino]-N-(3-methylsulfanylphenyl)ethanamide

Systemtic Name: 2-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl-methyl-amino]-N-(3-methylsulfanylphenyl)ethanamide Openeye Name: 2-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl-methyl-amino]-N-(3-methylsulfanylphenyl)acetamide CAS Name: 2-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl-methylamino]-N-[3-(methylthio)phenyl]acetamide IUPAC Name: 2-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl-methylamino]-N-(3-methylsulfanylphenyl)acetamide Traditional Name: 2-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl-methyl-amino]-N-[3-(methylthio)phenyl]acetamide Formula: C21H27N3O2S MolecularWeight: 385.52298

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC(OC2=CC=CC=C21)CN(C)CC(=O)NC3=CC(=CC=C3)SC

Isomeric SMILES

CCN1C[C@@H](OC2=CC=CC=C21)CN(C)CC(=O)NC3=CC(=CC=C3)SC

InChI

InChI=1S/C21H27N3O2S/c1-4-24-14-17(26-20-11-6-5-10-19(20)24)13-23(2)15-21(25)22-16-8-7-9-18(12-16)27-3/h5-12,17H,4,13-15H2,1-3H3,(H,22,25)/t17-/m0/s1