4-[[7-(5-cyano-2-methyl-phenyl)-6-methyl-1,2,4-benzotriazin-3-yl]amino]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide

Systemtic Name: 4-[[7-(5-cyano-2-methyl-phenyl)-6-methyl-1,2,4-benzotriazin-3-yl]amino]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide Openeye Name: 4-[[7-(5-cyano-2-methyl-phenyl)-6-methyl-1,2,4-benzotriazin-3-yl]amino]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide CAS Name: 4-[[7-(5-cyano-2-methylphenyl)-6-methyl-1,2,4-benzotriazin-3-yl]amino]-N-[2-(1-pyrrolidinyl)ethyl]benzenesulfonamide IUPAC Name: 4-[[7-(5-cyano-2-methylphenyl)-6-methyl-1,2,4-benzotriazin-3-yl]amino]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide Traditional Name: 4-[[7-(5-cyano-2-methyl-phenyl)-6-methyl-1,2,4-benzotriazin-3-yl]amino]-N-(2-pyrrolidinoethyl)benzenesulfonamide Formula: C28H29N7O2S MolecularWeight: 527.64056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C#N)C2=CC3=C(C=C2C)N=C(N=N3)NC4=CC=C(C=C4)S(=O)(=O)NCCN5CCCC5

Isomeric SMILES

CC1=C(C=C(C=C1)C#N)C2=CC3=C(C=C2C)N=C(N=N3)NC4=CC=C(C=C4)S(=O)(=O)NCCN5CCCC5

InChI

InChI=1S/C28H29N7O2S/c1-19-5-6-21(18-29)16-24(19)25-17-27-26(15-20(25)2)32-28(34-33-27)31-22-7-9-23(10-8-22)38(36,37)30-11-14-35-12-3-4-13-35/h5-10,15-17,30H,3-4,11-14H2,1-2H3,(H,31,32,34)