2-azanyl-N-(3-phenylpropyl)-1-[(E)-thiophen-2-ylmethylideneamino]pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-N-(3-phenylpropyl)-1-[(E)-thiophen-2-ylmethylideneamino]pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-N-(3-phenylpropyl)-1-[(E)-2-thienylmethyleneamino]pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-N-(3-phenylpropyl)-1-[(E)-thiophen-2-ylmethylideneamino]-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-N-(3-phenylpropyl)-1-[(E)-thiophen-2-ylmethylideneamino]pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-N-(3-phenylpropyl)-1-[(E)-2-thenylideneamino]pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C25H22N6OS MolecularWeight: 454.54678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCNC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)N=CC5=CC=CS5)N

Isomeric SMILES

C1=CC=C(C=C1)CCCNC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)/N=C/C5=CC=CS5)N

InChI

InChI=1S/C25H22N6OS/c26-23-21(25(32)27-14-6-10-17-8-2-1-3-9-17)22-24(30-20-13-5-4-12-19(20)29-22)31(23)28-16-18-11-7-15-33-18/h1-5,7-9,11-13,15-16H,6,10,14,26H2,(H,27,32)/b28-16+