tert-butyl N-[2-(1-acetamido-2-oxidanyl-but-3-enyl)-4-(1,3-dithian-2-ylidene)cyclopentyl]carbamate

Systemtic Name: tert-butyl N-[2-(1-acetamido-2-oxidanyl-but-3-enyl)-4-(1,3-dithian-2-ylidene)cyclopentyl]carbamate Openeye Name: tert-butyl N-[2-(1-acetamido-2-hydroxy-but-3-enyl)-4-(1,3-dithian-2-ylidene)cyclopentyl]carbamate CAS Name: N-[2-(1-acetamido-2-hydroxybut-3-enyl)-4-(1,3-dithian-2-ylidene)cyclopentyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-(1-acetamido-2-hydroxybut-3-enyl)-4-(1,3-dithian-2-ylidene)cyclopentyl]carbamate Traditional Name: N-[2-(1-acetamido-2-hydroxy-but-3-enyl)-4-(1,3-dithian-2-ylidene)cyclopentyl]carbamic acid tert-butyl ester Formula: C20H32N2O4S2 MolecularWeight: 428.60908

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(C1CC(=C2SCCCS2)CC1NC(=O)OC(C)(C)C)C(C=C)O

Isomeric SMILES

CC(=O)NC(C1CC(=C2SCCCS2)CC1NC(=O)OC(C)(C)C)C(C=C)O

InChI

InChI=1S/C20H32N2O4S2/c1-6-16(24)17(21-12(2)23)14-10-13(18-27-8-7-9-28-18)11-15(14)22-19(25)26-20(3,4)5/h6,14-17,24H,1,7-11H2,2-5H3,(H,21,23)(H,22,25)