N-[(3-chloranyl-4-methoxy-phenyl)methyl]-5,6-dimethyl-2-pyrazol-1-yl-thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: N-[(3-chloranyl-4-methoxy-phenyl)methyl]-5,6-dimethyl-2-pyrazol-1-yl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-[(3-chloro-4-methoxy-phenyl)methyl]-5,6-dimethyl-2-pyrazol-1-yl-thieno[2,3-d]pyrimidin-4-amine CAS Name: N-[(3-chloro-4-methoxyphenyl)methyl]-5,6-dimethyl-2-(1-pyrazolyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-[(3-chloro-4-methoxyphenyl)methyl]-5,6-dimethyl-2-pyrazol-1-ylthieno[2,3-d]pyrimidin-4-amine Traditional Name: (3-chloro-4-methoxy-benzyl)-(5,6-dimethyl-2-pyrazol-1-yl-thieno[2,3-d]pyrimidin-4-yl)amine Formula: C19H18ClN5OS MolecularWeight: 399.89712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)NCC3=CC(=C(C=C3)OC)Cl)N4C=CC=N4)C

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)NCC3=CC(=C(C=C3)OC)Cl)N4C=CC=N4)C

InChI

InChI=1S/C19H18ClN5OS/c1-11-12(2)27-18-16(11)17(23-19(24-18)25-8-4-7-22-25)21-10-13-5-6-15(26-3)14(20)9-13/h4-9H,10H2,1-3H3,(H,21,23,24)