4,4-dimethyl-2-[(E)-5-phenylpent-4-enyl]isoquinoline-1,3-dithione

Systemtic Name: 4,4-dimethyl-2-[(E)-5-phenylpent-4-enyl]isoquinoline-1,3-dithione Openeye Name: 4,4-dimethyl-2-[(E)-5-phenylpent-4-enyl]isoquinoline-1,3-dithione CAS Name: 4,4-dimethyl-2-[(E)-5-phenylpent-4-enyl]isoquinoline-1,3-dithione IUPAC Name: 4,4-dimethyl-2-[(E)-5-phenylpent-4-enyl]isoquinoline-1,3-dithione Traditional Name: 4,4-dimethyl-2-[(E)-5-phenylpent-4-enyl]isoquinoline-1,3-dithione Formula: C22H23NS2 MolecularWeight: 365.55472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2C(=S)N(C1=S)CCCC=CC3=CC=CC=C3)C

Isomeric SMILES

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

InChI

InChI=1S/C22H23NS2/c1-22(2)19-15-9-8-14-18(19)20(24)23(21(22)25)16-10-4-7-13-17-11-5-3-6-12-17/h3,5-9,11-15H,4,10,16H2,1-2H3/b13-7+