azane; benzene; 7-butan-2-yl-4-ethenyl-6-methyl-2-propoxy-2,3-dihydropteridine

Systemtic Name: azane; benzene; 7-butan-2-yl-4-ethenyl-6-methyl-2-propoxy-2,3-dihydropteridine Openeye Name: ammonia; benzene; 6-methyl-2-propoxy-7-sec-butyl-4-vinyl-2,3-dihydropteridine CAS Name: ammonia; benzene; 7-butan-2-yl-4-ethenyl-6-methyl-2-propoxy-2,3-dihydropteridine IUPAC Name: azane; benzene; 7-butan-2-yl-4-ethenyl-6-methyl-2-propoxy-2,3-dihydropteridine Traditional Name: ammonia; benzene; 6-methyl-2-propoxy-7-sec-butyl-4-vinyl-2,3-dihydropteridine Formula: C22H33N5O MolecularWeight: 383.53032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1NC(=C2C(=N1)N=C(C(=N2)C)C(C)CC)C=C.C1=CC=CC=C1.N

Isomeric SMILES

CCCOC1NC(=C2C(=N1)N=C(C(=N2)C)C(C)CC)C=C.C1=CC=CC=C1.N

InChI

InChI=1S/C16H24N4O.C6H6.H3N/c1-6-9-21-16-18-12(8-3)14-15(20-16)19-13(10(4)7-2)11(5)17-14;1-2-4-6-5-3-1;/h8,10,16,18H,3,6-7,9H2,1-2,4-5H3;1-6H;1H3