ethyl (E)-4-carbamimidoylsulfanyl-5-phenyl-pent-2-enoate

Systemtic Name: ethyl (E)-4-carbamimidoylsulfanyl-5-phenyl-pent-2-enoate Openeye Name: ethyl (E)-4-carbamimidoylsulfanyl-5-phenyl-pent-2-enoate CAS Name: (E)-4-(carbamimidoylthio)-5-phenyl-2-pentenoic acid ethyl ester IUPAC Name: ethyl (E)-4-carbamimidoylsulfanyl-5-phenylpent-2-enoate Traditional Name: (E)-4-(amidinothio)-5-phenyl-pent-2-enoic acid ethyl ester Formula: C14H18N2O2S MolecularWeight: 278.36992

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(CC1=CC=CC=C1)SC(=N)N

Isomeric SMILES

CCOC(=O)/C=C/C(CC1=CC=CC=C1)SC(=N)N

InChI

InChI=1S/C14H18N2O2S/c1-2-18-13(17)9-8-12(19-14(15)16)10-11-6-4-3-5-7-11/h3-9,12H,2,10H2,1H3,(H3,15,16)/b9-8+