5,6-bis(azanyl)-8-[bis(2-hydroxyethyl)amino]-2-oxidanylidene-3-[[(2R)-oxolan-2-yl]methyl]-1H-pyrrolo[2,3-c][2,7]naphthyridine-9-carbonitrile

Systemtic Name: 5,6-bis(azanyl)-8-[bis(2-hydroxyethyl)amino]-2-oxidanylidene-3-[[(2R)-oxolan-2-yl]methyl]-1H-pyrrolo[2,3-c][2,7]naphthyridine-9-carbonitrile Openeye Name: 5,6-diamino-8-[bis(2-hydroxyethyl)amino]-2-oxo-3-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-pyrrolo[2,3-c][2,7]naphthyridine-9-carbonitrile CAS Name: 5,6-diamino-8-[bis(2-hydroxyethyl)amino]-2-oxo-3-[[(2R)-2-oxolanyl]methyl]-1H-pyrrolo[2,3-c][2,7]naphthyridine-9-carbonitrile IUPAC Name: 5,6-diamino-8-[bis(2-hydroxyethyl)amino]-2-oxo-3-[[(2R)-oxolan-2-yl]methyl]-1H-pyrrolo[2,3-c][2,7]naphthyridine-9-carbonitrile Traditional Name: 5,6-diamino-8-[bis(2-hydroxyethyl)amino]-2-keto-3-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-pyrrolo[2,3-c][2,7]naphthyridine-9-carbonitrile Formula: C20H25N7O4 MolecularWeight: 427.457

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(=O)CC3=C2N=C(C4=C(N=C(C(=C34)C#N)N(CCO)CCO)N)N

Isomeric SMILES

C1C[C@@H](OC1)CN2C(=O)CC3=C2N=C(C4=C(N=C(C(=C34)C#N)N(CCO)CCO)N)N

InChI

InChI=1S/C20H25N7O4/c21-9-13-15-12-8-14(30)27(10-11-2-1-7-31-11)20(12)25-18(23)16(15)17(22)24-19(13)26(3-5-28)4-6-29/h11,28-29H,1-8,10H2,(H2,22,24)(H2,23,25)/t11-/m1/s1