2-[(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl]sulfanyl-N,N,1-triethyl-benzimidazole-5-sulfonamide

Systemtic Name: 2-[(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl]sulfanyl-N,N,1-triethyl-benzimidazole-5-sulfonamide Openeye Name: 2-[(E)-4-amino-3-cyano-2-oxo-pent-3-enyl]sulfanyl-N,N,1-triethyl-benzimidazole-5-sulfonamide CAS Name: 2-[[(E)-4-amino-3-cyano-2-oxopent-3-enyl]thio]-N,N,1-triethyl-5-benzimidazolesulfonamide IUPAC Name: 2-[(E)-4-amino-3-cyano-2-oxopent-3-enyl]sulfanyl-N,N,1-triethylbenzimidazole-5-sulfonamide Traditional Name: 2-[[(E)-4-amino-3-cyano-2-keto-pent-3-enyl]thio]-N,N,1-triethyl-benzimidazole-5-sulfonamide Formula: C19H25N5O3S2 MolecularWeight: 435.5635

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)N=C1SCC(=O)C(=C(C)N)C#N

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)N=C1SCC(=O)/C(=C(\C)/N)/C#N

InChI

InChI=1S/C19H25N5O3S2/c1-5-23(6-2)29(26,27)14-8-9-17-16(10-14)22-19(24(17)7-3)28-12-18(25)15(11-20)13(4)21/h8-10H,5-7,12,21H2,1-4H3/b15-13+