3-azanyl-4-[3-[(phenylmethyl)-pyridin-2-yl-amino]propylamino]cyclobut-3-ene-1,2-dione

Systemtic Name: 3-azanyl-4-[3-[(phenylmethyl)-pyridin-2-yl-amino]propylamino]cyclobut-3-ene-1,2-dione Openeye Name: 3-amino-4-[3-[benzyl(2-pyridyl)amino]propylamino]cyclobut-3-ene-1,2-dione CAS Name: 3-amino-4-[3-[(phenylmethyl)-(2-pyridinyl)amino]propylamino]cyclobut-3-ene-1,2-dione IUPAC Name: 3-amino-4-[3-[benzyl(pyridin-2-yl)amino]propylamino]cyclobut-3-ene-1,2-dione Traditional Name: 3-amino-4-[3-[benzyl(2-pyridyl)amino]propylamino]cyclobut-3-ene-1,2-quinone Formula: C19H20N4O2 MolecularWeight: 336.3877

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CCCNC2=C(C(=O)C2=O)N)C3=CC=CC=N3

Isomeric SMILES

C1=CC=C(C=C1)CN(CCCNC2=C(C(=O)C2=O)N)C3=CC=CC=N3

InChI

InChI=1S/C19H20N4O2/c20-16-17(19(25)18(16)24)22-11-6-12-23(15-9-4-5-10-21-15)13-14-7-2-1-3-8-14/h1-5,7-10,22H,6,11-13,20H2