3-(2-azanyl-3-propylsulfonyl-benzimidazol-5-yl)-3-(3-fluorophenyl)-N-methyl-prop-2-enamide

Systemtic Name: 3-(2-azanyl-3-propylsulfonyl-benzimidazol-5-yl)-3-(3-fluorophenyl)-N-methyl-prop-2-enamide Openeye Name: 3-(2-amino-3-propylsulfonyl-benzimidazol-5-yl)-3-(3-fluorophenyl)-N-methyl-prop-2-enamide CAS Name: 3-(2-amino-3-propylsulfonyl-5-benzimidazolyl)-3-(3-fluorophenyl)-N-methyl-2-propenamide IUPAC Name: 3-(2-amino-3-propylsulfonylbenzimidazol-5-yl)-3-(3-fluorophenyl)-N-methylprop-2-enamide Traditional Name: 3-(2-amino-3-propylsulfonyl-benzimidazol-5-yl)-3-(3-fluorophenyl)-N-methyl-acrylamide Formula: C20H21FN4O3S MolecularWeight: 416.469143

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1C2=C(C=CC(=C2)C(=CC(=O)NC)C3=CC(=CC=C3)F)N=C1N

Isomeric SMILES

CCCS(=O)(=O)N1C2=C(C=CC(=C2)C(=CC(=O)NC)C3=CC(=CC=C3)F)N=C1N

InChI

InChI=1S/C20H21FN4O3S/c1-3-9-29(27,28)25-18-11-14(7-8-17(18)24-20(25)22)16(12-19(26)23-2)13-5-4-6-15(21)10-13/h4-8,10-12H,3,9H2,1-2H3,(H2,22,24)(H,23,26)