2-[4-(2-bromophenyl)sulfanyl-3-chloranyl-phenyl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)prop-2-en-1-one

Systemtic Name: 2-[4-(2-bromophenyl)sulfanyl-3-chloranyl-phenyl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)prop-2-en-1-one Openeye Name: 2-[4-(2-bromophenyl)sulfanyl-3-chloro-phenyl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)prop-2-en-1-one CAS Name: 2-[4-[(2-bromophenyl)thio]-3-chlorophenyl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-propen-1-one IUPAC Name: 2-[4-(2-bromophenyl)sulfanyl-3-chlorophenyl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)prop-2-en-1-one Traditional Name: 2-[4-[(2-bromophenyl)thio]-3-chloro-phenyl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)prop-2-en-1-one Formula: C24H19BrClNOS MolecularWeight: 484.83576

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C1=CC(=C(C=C1)SC2=CC=CC=C2Br)Cl)C(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

C=C(C1=CC(=C(C=C1)SC2=CC=CC=C2Br)Cl)C(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C24H19BrClNOS/c1-16(24(28)27-13-12-17-6-2-3-7-19(17)15-27)18-10-11-23(21(26)14-18)29-22-9-5-4-8-20(22)25/h2-11,14H,1,12-13,15H2