5,6-dimethyl-2-[1-[(4-pentylphenyl)amino]ethyl]-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-2-[1-[(4-pentylphenyl)amino]ethyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5,6-dimethyl-2-[1-(4-pentylanilino)ethyl]-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-2-[1-(4-pentylanilino)ethyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5,6-dimethyl-2-[1-(4-pentylanilino)ethyl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[1-(4-amylanilino)ethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C21H27N3OS MolecularWeight: 369.52358

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)NC(C)C2=NC3=C(C(=C(S3)C)C)C(=O)N2

Isomeric SMILES

CCCCCC1=CC=C(C=C1)NC(C)C2=NC3=C(C(=C(S3)C)C)C(=O)N2

InChI

InChI=1S/C21H27N3OS/c1-5-6-7-8-16-9-11-17(12-10-16)22-14(3)19-23-20(25)18-13(2)15(4)26-21(18)24-19/h9-12,14,22H,5-8H2,1-4H3,(H,23,24,25)