1-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-3-(1H-pyrazol-5-ylmethyl)urea

Systemtic Name: 1-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-3-(1H-pyrazol-5-ylmethyl)urea Openeye Name: 1-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-3-(1H-pyrazol-5-ylmethyl)urea CAS Name: 1-[4-[(4,6-dimethyl-2-pyrimidinyl)thio]phenyl]-3-(1H-pyrazol-5-ylmethyl)urea IUPAC Name: 1-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-3-(1H-pyrazol-5-ylmethyl)urea Traditional Name: 1-[4-[(4,6-dimethylpyrimidin-2-yl)thio]phenyl]-3-(1H-pyrazol-5-ylmethyl)urea Formula: C17H18N6OS MolecularWeight: 354.42942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC2=CC=C(C=C2)NC(=O)NCC3=CC=NN3)C

Isomeric SMILES

CC1=CC(=NC(=N1)SC2=CC=C(C=C2)NC(=O)NCC3=CC=NN3)C

InChI

InChI=1S/C17H18N6OS/c1-11-9-12(2)21-17(20-11)25-15-5-3-13(4-6-15)22-16(24)18-10-14-7-8-19-23-14/h3-9H,10H2,1-2H3,(H,19,23)(H2,18,22,24)