7-ethyl-3-(4-methoxyphenyl)sulfanyl-1,4-dimethyl-azulene

Systemtic Name: 7-ethyl-3-(4-methoxyphenyl)sulfanyl-1,4-dimethyl-azulene Openeye Name: 7-ethyl-3-(4-methoxyphenyl)sulfanyl-1,4-dimethyl-azulene CAS Name: 7-ethyl-3-[(4-methoxyphenyl)thio]-1,4-dimethylazulene IUPAC Name: 7-ethyl-3-(4-methoxyphenyl)sulfanyl-1,4-dimethylazulene Traditional Name: 7-ethyl-3-[(4-methoxyphenyl)thio]-1,4-dimethyl-azulene Formula: C21H22OS MolecularWeight: 322.46378

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C(C2=C(C=C1)C)SC3=CC=C(C=C3)OC)C

Isomeric SMILES

CCC1=CC2=C(C=C(C2=C(C=C1)C)SC3=CC=C(C=C3)OC)C

InChI

InChI=1S/C21H22OS/c1-5-16-7-6-14(2)21-19(13-16)15(3)12-20(21)23-18-10-8-17(22-4)9-11-18/h6-13H,5H2,1-4H3