4-methyl-5-[(E)-3-(2-oxidanylnaphthalen-1-yl)prop-2-enoyl]-1,3-thiazole-2-carbothioamide

Systemtic Name: 4-methyl-5-[(E)-3-(2-oxidanylnaphthalen-1-yl)prop-2-enoyl]-1,3-thiazole-2-carbothioamide Openeye Name: 5-[(E)-3-(2-hydroxy-1-naphthyl)prop-2-enoyl]-4-methyl-thiazole-2-carbothioamide CAS Name: 5-[(E)-3-(2-hydroxy-1-naphthalenyl)-1-oxoprop-2-enyl]-4-methyl-2-thiazolecarbothioamide IUPAC Name: 5-[(E)-3-(2-hydroxynaphthalen-1-yl)prop-2-enoyl]-4-methyl-1,3-thiazole-2-carbothioamide Traditional Name: 5-[(E)-3-(2-hydroxy-1-naphthyl)acryloyl]-4-methyl-thiazole-2-carbothioamide Formula: C18H14N2O2S2 MolecularWeight: 354.44596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C(=S)N)C(=O)C=CC2=C(C=CC3=CC=CC=C32)O

Isomeric SMILES

CC1=C(SC(=N1)C(=S)N)C(=O)/C=C/C2=C(C=CC3=CC=CC=C32)O

InChI

InChI=1S/C18H14N2O2S2/c1-10-16(24-18(20-10)17(19)23)15(22)9-7-13-12-5-3-2-4-11(12)6-8-14(13)21/h2-9,21H,1H3,(H2,19,23)/b9-7+