1-[6-diazo-4-methoxy-3-(4-methylphenyl)sulfanyl-cyclohexa-1,3-dien-1-yl]pyrrolidin-2-one

Systemtic Name: 1-[6-diazo-4-methoxy-3-(4-methylphenyl)sulfanyl-cyclohexa-1,3-dien-1-yl]pyrrolidin-2-one Openeye Name: 1-[6-diazo-4-methoxy-3-(p-tolylsulfanyl)cyclohexa-1,3-dien-1-yl]pyrrolidin-2-one CAS Name: 1-[6-diazo-4-methoxy-3-[(4-methylphenyl)thio]-1-cyclohexa-1,3-dienyl]-2-pyrrolidinone IUPAC Name: 1-[6-diazo-4-methoxy-3-(4-methylphenyl)sulfanylcyclohexa-1,3-dien-1-yl]pyrrolidin-2-one Traditional Name: 1-[6-diazo-4-methoxy-3-(p-tolylthio)cyclohexa-1,3-dien-1-yl]-2-pyrrolidone Formula: C18H19N3O2S MolecularWeight: 341.42736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(CC(=[N+]=[N-])C(=C2)N3CCCC3=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(CC(=[N+]=[N-])C(=C2)N3CCCC3=O)OC

InChI

InChI=1S/C18H19N3O2S/c1-12-5-7-13(8-6-12)24-17-11-15(21-9-3-4-18(21)22)14(20-19)10-16(17)23-2/h5-8,11H,3-4,9-10H2,1-2H3