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

Systemtic Name: 4-[[6-methyl-7-(2-methylphenyl)-1,2,4-benzotriazin-3-yl]amino]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide Openeye Name: 4-[[6-methyl-7-(o-tolyl)-1,2,4-benzotriazin-3-yl]amino]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide CAS Name: 4-[[6-methyl-7-(2-methylphenyl)-1,2,4-benzotriazin-3-yl]amino]-N-[2-(1-pyrrolidinyl)ethyl]benzenesulfonamide IUPAC Name: 4-[[6-methyl-7-(2-methylphenyl)-1,2,4-benzotriazin-3-yl]amino]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide Traditional Name: 4-[[6-methyl-7-(o-tolyl)-1,2,4-benzotriazin-3-yl]amino]-N-(2-pyrrolidinoethyl)benzenesulfonamide Formula: C27H30N6O2S MolecularWeight: 502.6311

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CC3=C(C=C2C)N=C(N=N3)NC4=CC=C(C=C4)S(=O)(=O)NCCN5CCCC5

Isomeric SMILES

CC1=CC=CC=C1C2=CC3=C(C=C2C)N=C(N=N3)NC4=CC=C(C=C4)S(=O)(=O)NCCN5CCCC5

InChI

InChI=1S/C27H30N6O2S/c1-19-7-3-4-8-23(19)24-18-26-25(17-20(24)2)30-27(32-31-26)29-21-9-11-22(12-10-21)36(34,35)28-13-16-33-14-5-6-15-33/h3-4,7-12,17-18,28H,5-6,13-16H2,1-2H3,(H,29,30,32)