6,7-bis(chloranyl)-3-(5-phenylthiophen-2-yl)-N-(4-pyrrolidin-1-ylbutyl)quinoxalin-2-amine

Systemtic Name: 6,7-bis(chloranyl)-3-(5-phenylthiophen-2-yl)-N-(4-pyrrolidin-1-ylbutyl)quinoxalin-2-amine Openeye Name: 6,7-dichloro-3-(5-phenyl-2-thienyl)-N-(4-pyrrolidin-1-ylbutyl)quinoxalin-2-amine CAS Name: 6,7-dichloro-3-(5-phenyl-2-thiophenyl)-N-[4-(1-pyrrolidinyl)butyl]-2-quinoxalinamine IUPAC Name: 6,7-dichloro-3-(5-phenylthiophen-2-yl)-N-(4-pyrrolidin-1-ylbutyl)quinoxalin-2-amine Traditional Name: [6,7-dichloro-3-(5-phenyl-2-thienyl)quinoxalin-2-yl]-(4-pyrrolidinobutyl)amine Formula: C26H26Cl2N4S MolecularWeight: 497.48244

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCCCNC2=NC3=CC(=C(C=C3N=C2C4=CC=C(S4)C5=CC=CC=C5)Cl)Cl

Isomeric SMILES

C1CCN(C1)CCCCNC2=NC3=CC(=C(C=C3N=C2C4=CC=C(S4)C5=CC=CC=C5)Cl)Cl

InChI

InChI=1S/C26H26Cl2N4S/c27-19-16-21-22(17-20(19)28)31-26(29-12-4-5-13-32-14-6-7-15-32)25(30-21)24-11-10-23(33-24)18-8-2-1-3-9-18/h1-3,8-11,16-17H,4-7,12-15H2,(H,29,31)