3-[azanyl-(1-propan-2-ylsulfonylbenzimidazol-2-yl)amino]propanenitrile

Systemtic Name: 3-[azanyl-(1-propan-2-ylsulfonylbenzimidazol-2-yl)amino]propanenitrile Openeye Name: 3-[amino-(1-isopropylsulfonylbenzimidazol-2-yl)amino]propanenitrile CAS Name: 3-[amino-(1-propan-2-ylsulfonyl-2-benzimidazolyl)amino]propanenitrile IUPAC Name: 3-[amino-(1-propan-2-ylsulfonylbenzimidazol-2-yl)amino]propanenitrile Traditional Name: 3-[amino-(1-isopropylsulfonylbenzimidazol-2-yl)amino]propionitrile Formula: C13H17N5O2S MolecularWeight: 307.37138

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)N1C2=CC=CC=C2N=C1N(CCC#N)N

Isomeric SMILES

CC(C)S(=O)(=O)N1C2=CC=CC=C2N=C1N(CCC#N)N

InChI

InChI=1S/C13H17N5O2S/c1-10(2)21(19,20)18-12-7-4-3-6-11(12)16-13(18)17(15)9-5-8-14/h3-4,6-7,10H,5,9,15H2,1-2H3