methyl 2-[[6-[(1-methoxy-1-oxidanylidene-3-phenyl-propan-2-yl)carbamoyl]phenoxathiin-4-yl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[[6-[(1-methoxy-1-oxidanylidene-3-phenyl-propan-2-yl)carbamoyl]phenoxathiin-4-yl]carbonylamino]-3-phenyl-propanoate Openeye Name: methyl 2-[[6-[(1-benzyl-2-methoxy-2-oxo-ethyl)carbamoyl]phenoxathiine-4-carbonyl]amino]-3-phenyl-propanoate CAS Name: 2-[[[6-[[(1-methoxy-1-oxo-3-phenylpropan-2-yl)amino]-oxomethyl]-4-phenoxathiinyl]-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[[6-[(1-methoxy-1-oxo-3-phenylpropan-2-yl)carbamoyl]phenoxathiine-4-carbonyl]amino]-3-phenylpropanoate Traditional Name: 2-[[6-[(1-benzyl-2-keto-2-methoxy-ethyl)carbamoyl]phenoxathiine-4-carbonyl]amino]-3-phenyl-propionic acid methyl ester Formula: C34H30N2O7S MolecularWeight: 610.6762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)C2=C3C(=CC=C2)SC4=CC=CC(=C4O3)C(=O)NC(CC5=CC=CC=C5)C(=O)OC

Isomeric SMILES

COC(=O)C(CC1=CC=CC=C1)NC(=O)C2=C3C(=CC=C2)SC4=CC=CC(=C4O3)C(=O)NC(CC5=CC=CC=C5)C(=O)OC

InChI

InChI=1S/C34H30N2O7S/c1-41-33(39)25(19-21-11-5-3-6-12-21)35-31(37)23-15-9-17-27-29(23)43-30-24(16-10-18-28(30)44-27)32(38)36-26(34(40)42-2)20-22-13-7-4-8-14-22/h3-18,25-26H,19-20H2,1-2H3,(H,35,37)(H,36,38)