2-isocyanatoethyl (E)-2-methylidene-5-phenyl-4-sulfanyl-pent-4-enoate

Systemtic Name: 2-isocyanatoethyl (E)-2-methylidene-5-phenyl-4-sulfanyl-pent-4-enoate Openeye Name: 2-isocyanatoethyl (E)-2-methylene-5-phenyl-4-sulfanyl-pent-4-enoate CAS Name: (E)-4-mercapto-2-methylene-5-phenyl-4-pentenoic acid 2-isocyanatoethyl ester IUPAC Name: 2-isocyanatoethyl (E)-2-methylidene-5-phenyl-4-sulfanylpent-4-enoate Traditional Name: (E)-4-mercapto-2-methylene-5-phenyl-pent-4-enoic acid 2-isocyanatoethyl ester Formula: C15H15NO3S MolecularWeight: 289.3495

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Descriptors Computed from Structure

Canonical SMILES:

C=C(CC(=CC1=CC=CC=C1)S)C(=O)OCCN=C=O

Isomeric SMILES

C=C(C/C(=C\C1=CC=CC=C1)/S)C(=O)OCCN=C=O

InChI

InChI=1S/C15H15NO3S/c1-12(15(18)19-8-7-16-11-17)9-14(20)10-13-5-3-2-4-6-13/h2-6,10,20H,1,7-9H2/b14-10+