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methyl 2-[(1-adamantylamino)methyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate

methyl 2-[(1-adamantylamino)methyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name:methyl 2-[(1-adamantylamino)methyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate
Openeye Name:methyl 2-[(1-adamantylamino)methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate
CAS Name:2-[(1-adamantylamino)methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester
IUPAC Name:methyl 2-[(1-adamantylamino)methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate
Traditional Name:2-[(1-adamantylamino)methyl]-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester
Formula: C20H25N3O3S
MolecularWeight: 387.4958
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CNC34CC5CC(C3)CC(C5)C4)C(=O)OC


Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CNC34CC5CC(C3)CC(C5)C4)C(=O)OC


InChI

InChI=1S/C20H25N3O3S/c1-10-15-17(24)22-14(23-18(15)27-16(10)19(25)26-2)9-21-20-6-11-3-12(7-20)5-13(4-11)8-20/h11-13,21H,3-9H2,1-2H3,(H,22,23,24)


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