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

Systemtic Name: N-[(3-chloranyl-4-methoxy-phenyl)methyl]-5-methyl-2-pyrazol-1-yl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-[(3-chloro-4-methoxy-phenyl)methyl]-5-methyl-2-pyrazol-1-yl-thieno[2,3-d]pyrimidin-4-amine CAS Name: N-[(3-chloro-4-methoxyphenyl)methyl]-5-methyl-2-(1-pyrazolyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-[(3-chloro-4-methoxyphenyl)methyl]-5-methyl-2-pyrazol-1-ylthieno[2,3-d]pyrimidin-4-amine Traditional Name: (3-chloro-4-methoxy-benzyl)-(5-methyl-2-pyrazol-1-yl-thieno[2,3-d]pyrimidin-4-yl)amine Formula: C18H16ClN5OS MolecularWeight: 385.87054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC2=NC(=NC(=C12)NCC3=CC(=C(C=C3)OC)Cl)N4C=CC=N4

Isomeric SMILES

CC1=CSC2=NC(=NC(=C12)NCC3=CC(=C(C=C3)OC)Cl)N4C=CC=N4

InChI

InChI=1S/C18H16ClN5OS/c1-11-10-26-17-15(11)16(22-18(23-17)24-7-3-6-21-24)20-9-12-4-5-14(25-2)13(19)8-12/h3-8,10H,9H2,1-2H3,(H,20,22,23)