5-[(3-chloranyl-4-methoxy-phenyl)amino]-1,3-dimethyl-6-prop-2-enyl-pyrazolo[4,3-d]pyrimidin-7-one

Systemtic Name: 5-[(3-chloranyl-4-methoxy-phenyl)amino]-1,3-dimethyl-6-prop-2-enyl-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 6-allyl-5-(3-chloro-4-methoxy-anilino)-1,3-dimethyl-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 5-(3-chloro-4-methoxyanilino)-1,3-dimethyl-6-prop-2-enyl-7-pyrazolo[4,3-d]pyrimidinone IUPAC Name: 5-(3-chloro-4-methoxyanilino)-1,3-dimethyl-6-prop-2-enylpyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 6-allyl-5-(3-chloro-4-methoxy-anilino)-1,3-dimethyl-pyrazolo[4,3-d]pyrimidin-7-one Formula: C17H18ClN5O2 MolecularWeight: 359.81012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1N=C(N(C2=O)CC=C)NC3=CC(=C(C=C3)OC)Cl)C

Isomeric SMILES

CC1=NN(C2=C1N=C(N(C2=O)CC=C)NC3=CC(=C(C=C3)OC)Cl)C

InChI

InChI=1S/C17H18ClN5O2/c1-5-8-23-16(24)15-14(10(2)21-22(15)3)20-17(23)19-11-6-7-13(25-4)12(18)9-11/h5-7,9H,1,8H2,2-4H3,(H,19,20)