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

Systemtic Name: tert-butyl [(6-methoxy-3,4-dihydro-2H-thiochromen-2-yl)methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino] carbonate Openeye Name: [tert-butoxycarbonyl-[(6-methoxythiochroman-2-yl)methyl]amino] tert-butyl carbonate CAS Name: carbonic acid tert-butyl [(6-methoxy-3,4-dihydro-2H-1-benzothiopyran-2-yl)methyl-[(2-methylpropan-2-yl)oxy-oxomethyl]amino] ester IUPAC Name: tert-butyl [(6-methoxy-3,4-dihydro-2H-thiochromen-2-yl)methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino] carbonate Traditional Name: carbonic acid [tert-butoxycarbonyl-[(6-methoxythiochroman-2-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(CC1CCC2=C(S1)C=CC(=C2)OC)OC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)N(CC1CCC2=C(S1)C=CC(=C2)OC)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)13-16-10-8-14-12-15(25-7)9-11-17(14)29-16/h9,11-12,16H,8,10,13H2,1-7H3