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

Systemtic Name: 4-[[7-(3-aminophenyl)-5-methyl-1,2,4-benzotriazin-3-yl]amino]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide Openeye Name: 4-[[7-(3-aminophenyl)-5-methyl-1,2,4-benzotriazin-3-yl]amino]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide CAS Name: 4-[[7-(3-aminophenyl)-5-methyl-1,2,4-benzotriazin-3-yl]amino]-N-[2-(1-pyrrolidinyl)ethyl]benzenesulfonamide IUPAC Name: 4-[[7-(3-aminophenyl)-5-methyl-1,2,4-benzotriazin-3-yl]amino]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide Traditional Name: 4-[[7-(3-aminophenyl)-5-methyl-1,2,4-benzotriazin-3-yl]amino]-N-(2-pyrrolidinoethyl)benzenesulfonamide Formula: C26H29N7O2S MolecularWeight: 503.61916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)C3=CC(=CC=C3)N)N=NC(=N2)NC4=CC=C(C=C4)S(=O)(=O)NCCN5CCCC5

Isomeric SMILES

CC1=C2C(=CC(=C1)C3=CC(=CC=C3)N)N=NC(=N2)NC4=CC=C(C=C4)S(=O)(=O)NCCN5CCCC5

InChI

InChI=1S/C26H29N7O2S/c1-18-15-20(19-5-4-6-21(27)16-19)17-24-25(18)30-26(32-31-24)29-22-7-9-23(10-8-22)36(34,35)28-11-14-33-12-2-3-13-33/h4-10,15-17,28H,2-3,11-14,27H2,1H3,(H,29,30,32)