2-chloranyl-3-[2,2-dimethyl-4-(prop-2-enylsulfanylmethyl)-1H-quinolin-6-yl]phenol

Systemtic Name: 2-chloranyl-3-[2,2-dimethyl-4-(prop-2-enylsulfanylmethyl)-1H-quinolin-6-yl]phenol Openeye Name: 3-[4-(allylsulfanylmethyl)-2,2-dimethyl-1H-quinolin-6-yl]-2-chloro-phenol CAS Name: 2-chloro-3-[2,2-dimethyl-4-[(prop-2-enylthio)methyl]-1H-quinolin-6-yl]phenol IUPAC Name: 2-chloro-3-[2,2-dimethyl-4-(prop-2-enylsulfanylmethyl)-1H-quinolin-6-yl]phenol Traditional Name: 3-[4-[(allylthio)methyl]-2,2-dimethyl-1H-quinolin-6-yl]-2-chloro-phenol Formula: C21H22ClNOS MolecularWeight: 371.92348

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=C(C2=C(N1)C=CC(=C2)C3=C(C(=CC=C3)O)Cl)CSCC=C)C

Isomeric SMILES

CC1(C=C(C2=C(N1)C=CC(=C2)C3=C(C(=CC=C3)O)Cl)CSCC=C)C

InChI

InChI=1S/C21H22ClNOS/c1-4-10-25-13-15-12-21(2,3)23-18-9-8-14(11-17(15)18)16-6-5-7-19(24)20(16)22/h4-9,11-12,23-24H,1,10,13H2,2-3H3