3-methylbut-2-enethioamide; (E)-3-phenylprop-2-enethioamide

Systemtic Name: 3-methylbut-2-enethioamide; (E)-3-phenylprop-2-enethioamide Openeye Name: 3-methylbut-2-enethioamide; (E)-3-phenylprop-2-enethioamide CAS Name: 3-methyl-2-butenethioamide; (E)-3-phenyl-2-propenethioamide IUPAC Name: 3-methylbut-2-enethioamide; (E)-3-phenylprop-2-enethioamide Traditional Name: 3-methylbut-2-enethioamide; (E)-3-phenylthioacrylamide Formula: C14H18N2S2 MolecularWeight: 278.43612

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=S)N)C.C1=CC=C(C=C1)C=CC(=S)N

Isomeric SMILES

CC(=CC(=S)N)C.C1=CC=C(C=C1)/C=C/C(=S)N

InChI

InChI=1S/C9H9NS.C5H9NS/c10-9(11)7-6-8-4-2-1-3-5-8;1-4(2)3-5(6)7/h1-7H,(H2,10,11);3H,1-2H3,(H2,6,7)/b7-6+;