tert-butyl [(6-methoxy-3,4-dihydro-2H-thiochromen-3-yl)methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino] carbonate

Systemtic Name: tert-butyl [(6-methoxy-3,4-dihydro-2H-thiochromen-3-yl)methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino] carbonate Openeye Name: [tert-butoxycarbonyl-[(6-methoxythiochroman-3-yl)methyl]amino] tert-butyl carbonate CAS Name: carbonic acid tert-butyl [(6-methoxy-3,4-dihydro-2H-1-benzothiopyran-3-yl)methyl-[(2-methylpropan-2-yl)oxy-oxomethyl]amino] ester IUPAC Name: tert-butyl [(6-methoxy-3,4-dihydro-2H-thiochromen-3-yl)methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino] carbonate Traditional Name: carbonic acid [tert-butoxycarbonyl-[(6-methoxythiochroman-3-yl)methyl]amino] tert-butyl ester Formula: C21H31NO6S MolecularWeight: 425.53894

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CC1CC2=C(C=CC(=C2)OC)SC1)OC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)N(CC1CC2=C(C=CC(=C2)OC)SC1)OC(=O)OC(C)(C)C

InChI

InChI=1S/C21H31NO6S/c1-20(2,3)26-18(23)22(28-19(24)27-21(4,5)6)12-14-10-15-11-16(25-7)8-9-17(15)29-13-14/h8-9,11,14H,10,12-13H2,1-7H3