methyl (1Z)-N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methyl-amino]sulfanyl-2-phenyl-propanimidate

Systemtic Name: methyl (1Z)-N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methyl-amino]sulfanyl-2-phenyl-propanimidate Openeye Name: methyl (1Z)-N-[(2,2-dimethyl-3H-benzofuran-7-yl)oxycarbonyl-methyl-amino]sulfanyl-2-phenyl-propanimidate CAS Name: (1Z)-N-[[[(2,2-dimethyl-3H-benzofuran-7-yl)oxy-oxomethyl]-methylamino]thio]-2-phenylpropanimidic acid methyl ester IUPAC Name: methyl (1Z)-N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-2-phenylpropanimidate Traditional Name: (1Z)-N-[[(2,2-dimethylcoumaran-7-yl)oxycarbonyl-methyl-amino]thio]-2-phenyl-propionimidic acid methyl ester Formula: C22H26N2O4S MolecularWeight: 414.51784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)C(=NSN(C)C(=O)OC2=CC=CC3=C2OC(C3)(C)C)OC

Isomeric SMILES

CC(C1=CC=CC=C1)/C(=N/SN(C)C(=O)OC2=CC=CC3=C2OC(C3)(C)C)/OC

InChI

InChI=1S/C22H26N2O4S/c1-15(16-10-7-6-8-11-16)20(26-5)23-29-24(4)21(25)27-18-13-9-12-17-14-22(2,3)28-19(17)18/h6-13,15H,14H2,1-5H3/b23-20-