5-[(4-bromanyl-8-methoxy-spiro[chromene-2,4'-piperidine]-6-yl)methyl]pyrimidine-2,4-diamine

Systemtic Name: 5-[(4-bromanyl-8-methoxy-spiro[chromene-2,4'-piperidine]-6-yl)methyl]pyrimidine-2,4-diamine Openeye Name: 5-[(4-bromo-8-methoxy-spiro[chromene-2,4'-piperidine]-6-yl)methyl]pyrimidine-2,4-diamine CAS Name: 5-[(4-bromo-8-methoxy-6-spiro[1-benzopyran-2,4'-piperidine]yl)methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[(4-bromo-8-methoxyspiro[chromene-2,4'-piperidine]-6-yl)methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-[(4-bromo-8-methoxy-spiro[chromene-2,4'-piperidine]-6-yl)methyl]pyrimidin-4-yl]amine Formula: C19H22BrN5O2 MolecularWeight: 432.31428

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1)CC3=CN=C(N=C3N)N)C(=CC4(O2)CCNCC4)Br

Isomeric SMILES

COC1=C2C(=CC(=C1)CC3=CN=C(N=C3N)N)C(=CC4(O2)CCNCC4)Br

InChI

InChI=1S/C19H22BrN5O2/c1-26-15-8-11(6-12-10-24-18(22)25-17(12)21)7-13-14(20)9-19(27-16(13)15)2-4-23-5-3-19/h7-10,23H,2-6H2,1H3,(H4,21,22,24,25)