3-(1,3-benzothiazol-2-yl)-1-(2-dimethylaminoethyl)pyrrolo[3,2-b]quinoxalin-2-amine

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-1-(2-dimethylaminoethyl)pyrrolo[3,2-b]quinoxalin-2-amine Openeye Name: 3-(1,3-benzothiazol-2-yl)-1-(2-dimethylaminoethyl)pyrrolo[3,2-b]quinoxalin-2-amine CAS Name: 3-(1,3-benzothiazol-2-yl)-1-(2-dimethylaminoethyl)-2-pyrrolo[3,2-b]quinoxalinamine IUPAC Name: 3-(1,3-benzothiazol-2-yl)-1-(2-dimethylaminoethyl)pyrrolo[3,2-b]quinoxalin-2-amine Traditional Name: 2-[2-amino-3-(1,3-benzothiazol-2-yl)pyrrolo[3,2-b]quinoxalin-1-yl]ethyl-dimethyl-amine Formula: C21H20N6S MolecularWeight: 388.4887

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN1C(=C(C2=NC3=CC=CC=C3N=C21)C4=NC5=CC=CC=C5S4)N

Isomeric SMILES

CN(C)CCN1C(=C(C2=NC3=CC=CC=C3N=C21)C4=NC5=CC=CC=C5S4)N

InChI

InChI=1S/C21H20N6S/c1-26(2)11-12-27-19(22)17(21-25-15-9-5-6-10-16(15)28-21)18-20(27)24-14-8-4-3-7-13(14)23-18/h3-10H,11-12,22H2,1-2H3