tert-butyl N-[(2S,3R)-4-[(2-but-3-enoxy-4-methoxy-phenyl)sulfonyl-prop-2-enyl-amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S,3R)-4-[(2-but-3-enoxy-4-methoxy-phenyl)sulfonyl-prop-2-enyl-amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S,2R)-3-[allyl-(2-but-3-enoxy-4-methoxy-phenyl)sulfonyl-amino]-1-benzyl-2-hydroxy-propyl]carbamate CAS Name: N-[(2S,3R)-4-[(2-but-3-enoxy-4-methoxyphenyl)sulfonyl-prop-2-enylamino]-3-hydroxy-1-phenylbutan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S,3R)-4-[(2-but-3-enoxy-4-methoxyphenyl)sulfonyl-prop-2-enylamino]-3-hydroxy-1-phenylbutan-2-yl]carbamate Traditional Name: N-[(1S,2R)-3-[allyl-(2-but-3-enoxy-4-methoxy-phenyl)sulfonyl-amino]-1-benzyl-2-hydroxy-propyl]carbamic acid tert-butyl ester Formula: C29H40N2O7S MolecularWeight: 560.7021

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(CN(CC=C)S(=O)(=O)C2=C(C=C(C=C2)OC)OCCC=C)O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)[C@@H](CN(CC=C)S(=O)(=O)C2=C(C=C(C=C2)OC)OCCC=C)O

InChI

InChI=1S/C29H40N2O7S/c1-7-9-18-37-26-20-23(36-6)15-16-27(26)39(34,35)31(17-8-2)21-25(32)24(19-22-13-11-10-12-14-22)30-28(33)38-29(3,4)5/h7-8,10-16,20,24-25,32H,1-2,9,17-19,21H2,3-6H3,(H,30,33)/t24-,25+/m0/s1