ethyl 4-benzamidosulfanyl-3-methyl-cyclohexa-1,3-diene-1-carboxylate

Systemtic Name: ethyl 4-benzamidosulfanyl-3-methyl-cyclohexa-1,3-diene-1-carboxylate Openeye Name: ethyl 4-benzamidosulfanyl-3-methyl-cyclohexa-1,3-diene-1-carboxylate CAS Name: 4-(benzamidothio)-3-methyl-1-cyclohexa-1,3-dienecarboxylic acid ethyl ester IUPAC Name: ethyl 4-benzamidosulfanyl-3-methylcyclohexa-1,3-diene-1-carboxylate Traditional Name: 4-(benzamidothio)-3-methyl-cyclohexa-1,3-diene-1-carboxylic acid ethyl ester Formula: C17H19NO3S MolecularWeight: 317.40266

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(CC1)SNC(=O)C2=CC=CC=C2)C

Isomeric SMILES

CCOC(=O)C1=CC(=C(CC1)SNC(=O)C2=CC=CC=C2)C

InChI

InChI=1S/C17H19NO3S/c1-3-21-17(20)14-9-10-15(12(2)11-14)22-18-16(19)13-7-5-4-6-8-13/h4-8,11H,3,9-10H2,1-2H3,(H,18,19)