tert-butyl N-[4-[(2-methylpropan-2-yl)oxycarbonylamino]butyl]-N-(2-methyl-3-sulfanylidene-6,7,8,9-tetrahydro-4H-benzo[g][1,4]benzoxazin-6-yl)carbamate

Systemtic Name: tert-butyl N-[4-[(2-methylpropan-2-yl)oxycarbonylamino]butyl]-N-(2-methyl-3-sulfanylidene-6,7,8,9-tetrahydro-4H-benzo[g][1,4]benzoxazin-6-yl)carbamate Openeye Name: tert-butyl N-[4-(tert-butoxycarbonylamino)butyl]-N-(2-methyl-3-thioxo-6,7,8,9-tetrahydro-4H-benzo[g][1,4]benzoxazin-6-yl)carbamate CAS Name: N-[4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butyl]-N-(2-methyl-3-sulfanylidene-6,7,8,9-tetrahydro-4H-benzo[g][1,4]benzoxazin-6-yl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[(2-methylpropan-2-yl)oxycarbonylamino]butyl]-N-(2-methyl-3-sulfanylidene-6,7,8,9-tetrahydro-4H-benzo[g][1,4]benzoxazin-6-yl)carbamate Traditional Name: N-[4-(tert-butoxycarbonylamino)butyl]-N-(2-methyl-3-thioxo-6,7,8,9-tetrahydro-4H-benzo[g][1,4]benzoxazin-6-yl)carbamic acid tert-butyl ester Formula: C27H41N3O5S MolecularWeight: 519.69654

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=S)NC2=C(O1)C=C3CCCC(C3=C2)N(CCCCNC(=O)OC(C)(C)C)C(=O)OC(C)(C)C

Isomeric SMILES

CC1C(=S)NC2=C(O1)C=C3CCCC(C3=C2)N(CCCCNC(=O)OC(C)(C)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C27H41N3O5S/c1-17-23(36)29-20-16-19-18(15-22(20)33-17)11-10-12-21(19)30(25(32)35-27(5,6)7)14-9-8-13-28-24(31)34-26(2,3)4/h15-17,21H,8-14H2,1-7H3,(H,28,31)(H,29,36)