1-[2-[(5-chloranyl-1-benzothiophen-3-yl)methylamino]ethyl]-6-methyl-3-(phenethylamino)pyrazin-2-one

Systemtic Name: 1-[2-[(5-chloranyl-1-benzothiophen-3-yl)methylamino]ethyl]-6-methyl-3-(phenethylamino)pyrazin-2-one Openeye Name: 1-[2-[(5-chlorobenzothiophen-3-yl)methylamino]ethyl]-6-methyl-3-(phenethylamino)pyrazin-2-one CAS Name: 1-[2-[(5-chloro-1-benzothiophen-3-yl)methylamino]ethyl]-6-methyl-3-(phenethylamino)-2-pyrazinone IUPAC Name: 1-[2-[(5-chloro-1-benzothiophen-3-yl)methylamino]ethyl]-6-methyl-3-(phenethylamino)pyrazin-2-one Traditional Name: 1-[2-[(5-chlorobenzothiophen-3-yl)methylamino]ethyl]-6-methyl-3-(phenethylamino)pyrazin-2-one Formula: C24H25ClN4OS MolecularWeight: 452.9995

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C(=O)N1CCNCC2=CSC3=C2C=C(C=C3)Cl)NCCC4=CC=CC=C4

Isomeric SMILES

CC1=CN=C(C(=O)N1CCNCC2=CSC3=C2C=C(C=C3)Cl)NCCC4=CC=CC=C4

InChI

InChI=1S/C24H25ClN4OS/c1-17-14-28-23(27-10-9-18-5-3-2-4-6-18)24(30)29(17)12-11-26-15-19-16-31-22-8-7-20(25)13-21(19)22/h2-8,13-14,16,26H,9-12,15H2,1H3,(H,27,28)