(Z)-2-cyano-3-[3-(4-methylphenyl)-2,1-benzoxazol-5-yl]prop-2-enethioamide

Systemtic Name: (Z)-2-cyano-3-[3-(4-methylphenyl)-2,1-benzoxazol-5-yl]prop-2-enethioamide Openeye Name: (Z)-2-cyano-3-[3-(p-tolyl)-2,1-benzoxazol-5-yl]prop-2-enethioamide CAS Name: (Z)-2-cyano-3-[3-(4-methylphenyl)-2,1-benzoxazol-5-yl]-2-propenethioamide IUPAC Name: (Z)-2-cyano-3-[3-(4-methylphenyl)-2,1-benzoxazol-5-yl]prop-2-enethioamide Traditional Name: (Z)-2-cyano-3-[3-(p-tolyl)anthranil-5-yl]thioacrylamide Formula: C18H13N3OS MolecularWeight: 319.38032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C3C=C(C=CC3=NO2)C=C(C#N)C(=S)N

Isomeric SMILES

CC1=CC=C(C=C1)C2=C3C=C(C=CC3=NO2)/C=C(/C#N)\C(=S)N

InChI

InChI=1S/C18H13N3OS/c1-11-2-5-13(6-3-11)17-15-9-12(4-7-16(15)21-22-17)8-14(10-19)18(20)23/h2-9H,1H3,(H2,20,23)/b14-8-