5-[(8-methoxy-2,2-dimethyl-4-methylsulfanyl-chromen-6-yl)methyl]pyrimidine-2,4-diamine

Systemtic Name: 5-[(8-methoxy-2,2-dimethyl-4-methylsulfanyl-chromen-6-yl)methyl]pyrimidine-2,4-diamine Openeye Name: 5-[(8-methoxy-2,2-dimethyl-4-methylsulfanyl-chromen-6-yl)methyl]pyrimidine-2,4-diamine CAS Name: 5-[[8-methoxy-2,2-dimethyl-4-(methylthio)-1-benzopyran-6-yl]methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[(8-methoxy-2,2-dimethyl-4-methylsulfanylchromen-6-yl)methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-[[8-methoxy-2,2-dimethyl-4-(methylthio)chromen-6-yl]methyl]pyrimidin-4-yl]amine Formula: C18H22N4O2S MolecularWeight: 358.45788

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=C(C2=CC(=CC(=C2O1)OC)CC3=CN=C(N=C3N)N)SC)C

Isomeric SMILES

CC1(C=C(C2=CC(=CC(=C2O1)OC)CC3=CN=C(N=C3N)N)SC)C

InChI

InChI=1S/C18H22N4O2S/c1-18(2)8-14(25-4)12-6-10(7-13(23-3)15(12)24-18)5-11-9-21-17(20)22-16(11)19/h6-9H,5H2,1-4H3,(H4,19,20,21,22)