methyl 3-methyl-2-[2-oxidanylidene-4-sulfanylidene-3-[(triphenylmethyl)amino]azetidin-1-yl]but-2-enoate

Systemtic Name: methyl 3-methyl-2-[2-oxidanylidene-4-sulfanylidene-3-[(triphenylmethyl)amino]azetidin-1-yl]but-2-enoate Openeye Name: methyl 3-methyl-2-[2-oxo-4-thioxo-3-(tritylamino)azetidin-1-yl]but-2-enoate CAS Name: 3-methyl-2-[2-oxo-4-sulfanylidene-3-[(triphenylmethyl)amino]-1-azetidinyl]-2-butenoic acid methyl ester IUPAC Name: methyl 3-methyl-2-[2-oxo-4-sulfanylidene-3-(tritylamino)azetidin-1-yl]but-2-enoate Traditional Name: 2-[2-keto-4-thioxo-3-(tritylamino)azetidin-1-yl]-3-methyl-but-2-enoic acid methyl ester Formula: C28H26N2O3S MolecularWeight: 470.58264

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C(=O)OC)N1C(=O)C(C1=S)NC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC(=C(C(=O)OC)N1C(=O)C(C1=S)NC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C28H26N2O3S/c1-19(2)24(27(32)33-3)30-25(31)23(26(30)34)29-28(20-13-7-4-8-14-20,21-15-9-5-10-16-21)22-17-11-6-12-18-22/h4-18,23,29H,1-3H3