N-[(E)-[3-iodanyl-5-methoxy-4-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]-2,6-dipyrrolidin-1-yl-pyrimidin-4-amine

Systemtic Name: N-[(E)-[3-iodanyl-5-methoxy-4-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]-2,6-dipyrrolidin-1-yl-pyrimidin-4-amine Openeye Name: N-[(E)-[3-iodo-5-methoxy-4-(1-naphthylmethoxy)phenyl]methyleneamino]-2,6-dipyrrolidin-1-yl-pyrimidin-4-amine CAS Name: N-[(E)-[3-iodo-5-methoxy-4-(1-naphthalenylmethoxy)phenyl]methylideneamino]-2,6-bis(1-pyrrolidinyl)-4-pyrimidinamine IUPAC Name: N-[(E)-[3-iodo-5-methoxy-4-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]-2,6-dipyrrolidin-1-ylpyrimidin-4-amine Traditional Name: (2,6-dipyrrolidinopyrimidin-4-yl)-[(E)-[3-iodo-5-methoxy-4-(1-naphthylmethoxy)benzylidene]amino]amine Formula: C31H33IN6O2 MolecularWeight: 648.53719

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=NNC2=NC(=NC(=C2)N3CCCC3)N4CCCC4)I)OCC5=CC=CC6=CC=CC=C65

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=N/NC2=NC(=NC(=C2)N3CCCC3)N4CCCC4)I)OCC5=CC=CC6=CC=CC=C65

InChI

InChI=1S/C31H33IN6O2/c1-39-27-18-22(17-26(32)30(27)40-21-24-11-8-10-23-9-2-3-12-25(23)24)20-33-36-28-19-29(37-13-4-5-14-37)35-31(34-28)38-15-6-7-16-38/h2-3,8-12,17-20H,4-7,13-16,21H2,1H3,(H,34,35,36)/b33-20+