7-[3-[3,3-bis(fluoranyl)piperidin-1-yl]propoxy]-6-methoxy-4-piperazin-1-yl-quinazoline

Systemtic Name: 7-[3-[3,3-bis(fluoranyl)piperidin-1-yl]propoxy]-6-methoxy-4-piperazin-1-yl-quinazoline Openeye Name: 7-[3-(3,3-difluoro-1-piperidyl)propoxy]-6-methoxy-4-piperazin-1-yl-quinazoline CAS Name: 7-[3-(3,3-difluoro-1-piperidinyl)propoxy]-6-methoxy-4-(1-piperazinyl)quinazoline IUPAC Name: 7-[3-(3,3-difluoropiperidin-1-yl)propoxy]-6-methoxy-4-piperazin-1-ylquinazoline Traditional Name: 7-[3-(3,3-difluoropiperidino)propoxy]-6-methoxy-4-piperazino-quinazoline Formula: C21H29F2N5O2 MolecularWeight: 421.484066

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCNCC3)OCCCN4CCCC(C4)(F)F

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCNCC3)OCCCN4CCCC(C4)(F)F

InChI

InChI=1S/C21H29F2N5O2/c1-29-18-12-16-17(25-15-26-20(16)28-9-5-24-6-10-28)13-19(18)30-11-3-8-27-7-2-4-21(22,23)14-27/h12-13,15,24H,2-11,14H2,1H3