4-[1-(oxan-4-yloxy)but-2-ynylsulfanyl]-3-[(triphenylmethyl)amino]azetidin-2-one

Systemtic Name: 4-[1-(oxan-4-yloxy)but-2-ynylsulfanyl]-3-[(triphenylmethyl)amino]azetidin-2-one Openeye Name: 4-(1-tetrahydropyran-4-yloxybut-2-ynylsulfanyl)-3-(tritylamino)azetidin-2-one CAS Name: 4-[1-(4-oxanyloxy)but-2-ynylthio]-3-[(triphenylmethyl)amino]-2-azetidinone IUPAC Name: 4-[1-(oxan-4-yloxy)but-2-ynylsulfanyl]-3-(tritylamino)azetidin-2-one Traditional Name: 4-(1-tetrahydropyran-4-yloxybut-2-ynylthio)-3-(tritylamino)azetidin-2-one Formula: C31H32N2O3S MolecularWeight: 512.66238

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC(OC1CCOCC1)SC2C(C(=O)N2)NC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC#CC(OC1CCOCC1)SC2C(C(=O)N2)NC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H32N2O3S/c1-2-12-27(36-26-19-21-35-22-20-26)37-30-28(29(34)32-30)33-31(23-13-6-3-7-14-23,24-15-8-4-9-16-24)25-17-10-5-11-18-25/h3-11,13-18,26-28,30,33H,19-22H2,1H3,(H,32,34)