methyl (Z)-3-phenylazanyl-3-propylsulfanyl-prop-2-enoate

Systemtic Name: methyl (Z)-3-phenylazanyl-3-propylsulfanyl-prop-2-enoate Openeye Name: methyl (Z)-3-anilino-3-propylsulfanyl-prop-2-enoate CAS Name: (Z)-3-anilino-3-(propylthio)-2-propenoic acid methyl ester IUPAC Name: methyl (Z)-3-anilino-3-propylsulfanylprop-2-enoate Traditional Name: (Z)-3-anilino-3-(propylthio)acrylic acid methyl ester Formula: C13H17NO2S MolecularWeight: 251.34458

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC(=CC(=O)OC)NC1=CC=CC=C1

Isomeric SMILES

CCCS/C(=C\C(=O)OC)/NC1=CC=CC=C1

InChI

InChI=1S/C13H17NO2S/c1-3-9-17-12(10-13(15)16-2)14-11-7-5-4-6-8-11/h4-8,10,14H,3,9H2,1-2H3/b12-10-