N-[4-(2-cyclopropylpyrazolo[1,5-a]pyrimidin-7-yl)sulfanylphenyl]-4-(4-methylthiophen-2-yl)phthalazin-1-amine

Systemtic Name: N-[4-(2-cyclopropylpyrazolo[1,5-a]pyrimidin-7-yl)sulfanylphenyl]-4-(4-methylthiophen-2-yl)phthalazin-1-amine Openeye Name: N-[4-(2-cyclopropylpyrazolo[1,5-a]pyrimidin-7-yl)sulfanylphenyl]-4-(4-methyl-2-thienyl)phthalazin-1-amine CAS Name: N-[4-[(2-cyclopropyl-7-pyrazolo[1,5-a]pyrimidinyl)thio]phenyl]-4-(4-methyl-2-thiophenyl)-1-phthalazinamine IUPAC Name: N-[4-(2-cyclopropylpyrazolo[1,5-a]pyrimidin-7-yl)sulfanylphenyl]-4-(4-methylthiophen-2-yl)phthalazin-1-amine Traditional Name: [4-[(2-cyclopropylpyrazolo[1,5-a]pyrimidin-7-yl)thio]phenyl]-[4-(4-methyl-2-thienyl)phthalazin-1-yl]amine Formula: C28H22N6S2 MolecularWeight: 506.64448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC=C(C=C4)SC5=CC=NC6=CC(=NN56)C7CC7

Isomeric SMILES

CC1=CSC(=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC=C(C=C4)SC5=CC=NC6=CC(=NN56)C7CC7

InChI

InChI=1S/C28H22N6S2/c1-17-14-24(35-16-17)27-21-4-2-3-5-22(21)28(32-31-27)30-19-8-10-20(11-9-19)36-26-12-13-29-25-15-23(18-6-7-18)33-34(25)26/h2-5,8-16,18H,6-7H2,1H3,(H,30,32)