1-(7-azanylidene-2-cyclopropyl-5H-pyrrolo[3,4-b]pyridin-6-yl)-2-[4-methoxy-3-(3-oxidanylpropylamino)phenyl]hexan-1-one

Systemtic Name: 1-(7-azanylidene-2-cyclopropyl-5H-pyrrolo[3,4-b]pyridin-6-yl)-2-[4-methoxy-3-(3-oxidanylpropylamino)phenyl]hexan-1-one Openeye Name: 1-(2-cyclopropyl-7-imino-5H-pyrrolo[3,4-b]pyridin-6-yl)-2-[3-(3-hydroxypropylamino)-4-methoxy-phenyl]hexan-1-one CAS Name: 1-(2-cyclopropyl-7-imino-5H-pyrrolo[3,4-b]pyridin-6-yl)-2-[3-(3-hydroxypropylamino)-4-methoxyphenyl]-1-hexanone IUPAC Name: 1-(2-cyclopropyl-7-imino-5H-pyrrolo[3,4-b]pyridin-6-yl)-2-[3-(3-hydroxypropylamino)-4-methoxyphenyl]hexan-1-one Traditional Name: 1-(2-cyclopropyl-7-imino-5H-pyrrolo[3,4-b]pyridin-6-yl)-2-[3-(3-hydroxypropylamino)-4-methoxy-phenyl]hexan-1-one Formula: C26H34N4O3 MolecularWeight: 450.57316

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=CC(=C(C=C1)OC)NCCCO)C(=O)N2CC3=C(C2=N)N=C(C=C3)C4CC4

Isomeric SMILES

CCCCC(C1=CC(=C(C=C1)OC)NCCCO)C(=O)N2CC3=C(C2=N)N=C(C=C3)C4CC4

InChI

InChI=1S/C26H34N4O3/c1-3-4-6-20(18-10-12-23(33-2)22(15-18)28-13-5-14-31)26(32)30-16-19-9-11-21(17-7-8-17)29-24(19)25(30)27/h9-12,15,17,20,27-28,31H,3-8,13-14,16H2,1-2H3