4,4-dimethyl-2-(3-phenylbut-3-enyl)isoquinoline-1,3-dithione

Systemtic Name: 4,4-dimethyl-2-(3-phenylbut-3-enyl)isoquinoline-1,3-dithione Openeye Name: 4,4-dimethyl-2-(3-phenylbut-3-enyl)isoquinoline-1,3-dithione CAS Name: 4,4-dimethyl-2-(3-phenylbut-3-enyl)isoquinoline-1,3-dithione IUPAC Name: 4,4-dimethyl-2-(3-phenylbut-3-enyl)isoquinoline-1,3-dithione Traditional Name: 4,4-dimethyl-2-(3-phenylbut-3-enyl)isoquinoline-1,3-dithione Formula: C21H21NS2 MolecularWeight: 351.52814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2C(=S)N(C1=S)CCC(=C)C3=CC=CC=C3)C

Isomeric SMILES

CC1(C2=CC=CC=C2C(=S)N(C1=S)CCC(=C)C3=CC=CC=C3)C

InChI

InChI=1S/C21H21NS2/c1-15(16-9-5-4-6-10-16)13-14-22-19(23)17-11-7-8-12-18(17)21(2,3)20(22)24/h4-12H,1,13-14H2,2-3H3