2-butylsulfanyl-6-[(2E,4Z)-5-isothiocyanatohexa-2,4-dien-2-yl]naphthalene

Systemtic Name: 2-butylsulfanyl-6-[(2E,4Z)-5-isothiocyanatohexa-2,4-dien-2-yl]naphthalene Openeye Name: 2-butylsulfanyl-6-[(1E,3Z)-4-isothiocyanato-1-methyl-penta-1,3-dienyl]naphthalene CAS Name: 2-(butylthio)-6-[(2E,4Z)-5-isothiocyanatohexa-2,4-dien-2-yl]naphthalene IUPAC Name: 2-butylsulfanyl-6-[(2E,4Z)-5-isothiocyanatohexa-2,4-dien-2-yl]naphthalene Traditional Name: 2-(butylthio)-6-[(1E,3Z)-4-isothiocyanato-1-methyl-penta-1,3-dienyl]naphthalene Formula: C21H23NS2 MolecularWeight: 353.54402

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=CC2=C(C=C1)C=C(C=C2)C(=CC=C(C)N=C=S)C

Isomeric SMILES

CCCCSC1=CC2=C(C=C1)C=C(C=C2)/C(=C/C=C(/C)\N=C=S)/C

InChI

InChI=1S/C21H23NS2/c1-4-5-12-24-21-11-10-19-13-18(8-9-20(19)14-21)16(2)6-7-17(3)22-15-23/h6-11,13-14H,4-5,12H2,1-3H3/b16-6+,17-7-