N-[3-[6-(cyclopropylmethylamino)pyrimidin-4-yl]benzimidazol-5-yl]ethenesulfonamide

Systemtic Name: N-[3-[6-(cyclopropylmethylamino)pyrimidin-4-yl]benzimidazol-5-yl]ethenesulfonamide Openeye Name: N-[3-[6-(cyclopropylmethylamino)pyrimidin-4-yl]benzimidazol-5-yl]ethenesulfonamide CAS Name: N-[3-[6-(cyclopropylmethylamino)-4-pyrimidinyl]-5-benzimidazolyl]ethenesulfonamide IUPAC Name: N-[3-[6-(cyclopropylmethylamino)pyrimidin-4-yl]benzimidazol-5-yl]ethenesulfonamide Traditional Name: N-[3-[6-(cyclopropylmethylamino)pyrimidin-4-yl]benzimidazol-5-yl]ethenesulfonamide Formula: C17H18N6O2S MolecularWeight: 370.42882

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Descriptors Computed from Structure

Canonical SMILES:

C=CS(=O)(=O)NC1=CC2=C(C=C1)N=CN2C3=CC(=NC=N3)NCC4CC4

Isomeric SMILES

C=CS(=O)(=O)NC1=CC2=C(C=C1)N=CN2C3=CC(=NC=N3)NCC4CC4

InChI

InChI=1S/C17H18N6O2S/c1-2-26(24,25)22-13-5-6-14-15(7-13)23(11-21-14)17-8-16(19-10-20-17)18-9-12-3-4-12/h2,5-8,10-12,22H,1,3-4,9H2,(H,18,19,20)