4-[[4-(2,3-dimethylimidazol-4-yl)pyrimidin-2-yl]amino]-N-prop-2-enyl-benzenesulfonamide

Systemtic Name: 4-[[4-(2,3-dimethylimidazol-4-yl)pyrimidin-2-yl]amino]-N-prop-2-enyl-benzenesulfonamide Openeye Name: N-allyl-4-[[4-(2,3-dimethylimidazol-4-yl)pyrimidin-2-yl]amino]benzenesulfonamide CAS Name: 4-[[4-(2,3-dimethyl-4-imidazolyl)-2-pyrimidinyl]amino]-N-prop-2-enylbenzenesulfonamide IUPAC Name: 4-[[4-(2,3-dimethylimidazol-4-yl)pyrimidin-2-yl]amino]-N-prop-2-enylbenzenesulfonamide Traditional Name: N-allyl-4-[[4-(2,3-dimethylimidazol-4-yl)pyrimidin-2-yl]amino]benzenesulfonamide Formula: C18H20N6O2S MolecularWeight: 384.4554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1C)C2=NC(=NC=C2)NC3=CC=C(C=C3)S(=O)(=O)NCC=C

Isomeric SMILES

CC1=NC=C(N1C)C2=NC(=NC=C2)NC3=CC=C(C=C3)S(=O)(=O)NCC=C

InChI

InChI=1S/C18H20N6O2S/c1-4-10-21-27(25,26)15-7-5-14(6-8-15)22-18-19-11-9-16(23-18)17-12-20-13(2)24(17)3/h4-9,11-12,21H,1,10H2,2-3H3,(H,19,22,23)