[(2S)-4-[4-(methylsulfanylmethyl)phenyl]carbonyl-2,3-dihydro-1,4-benzoxazin-2-yl]-piperidin-1-yl-methanone

Systemtic Name: [(2S)-4-[4-(methylsulfanylmethyl)phenyl]carbonyl-2,3-dihydro-1,4-benzoxazin-2-yl]-piperidin-1-yl-methanone Openeye Name: [(2S)-4-[4-(methylsulfanylmethyl)benzoyl]-2,3-dihydro-1,4-benzoxazin-2-yl]-(1-piperidyl)methanone CAS Name: [(2S)-4-[[4-[(methylthio)methyl]phenyl]-oxomethyl]-2,3-dihydro-1,4-benzoxazin-2-yl]-(1-piperidinyl)methanone IUPAC Name: [(2S)-4-[4-(methylsulfanylmethyl)benzoyl]-2,3-dihydro-1,4-benzoxazin-2-yl]-piperidin-1-ylmethanone Traditional Name: [(2S)-4-[4-[(methylthio)methyl]benzoyl]-2,3-dihydro-1,4-benzoxazin-2-yl]-piperidino-methanone Formula: C23H26N2O3S MolecularWeight: 410.52914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCC1=CC=C(C=C1)C(=O)N2CC(OC3=CC=CC=C32)C(=O)N4CCCCC4

Isomeric SMILES

CSCC1=CC=C(C=C1)C(=O)N2C[C@H](OC3=CC=CC=C32)C(=O)N4CCCCC4

InChI

InChI=1S/C23H26N2O3S/c1-29-16-17-9-11-18(12-10-17)22(26)25-15-21(23(27)24-13-5-2-6-14-24)28-20-8-4-3-7-19(20)25/h3-4,7-12,21H,2,5-6,13-16H2,1H3/t21-/m0/s1