N4-[[4-(1H-indol-3-ylsulfonyl)phenyl]methyl]pyridine-3,4-diamine

Systemtic Name: N4-[[4-(1H-indol-3-ylsulfonyl)phenyl]methyl]pyridine-3,4-diamine Openeye Name: N4-[[4-(1H-indol-3-ylsulfonyl)phenyl]methyl]pyridine-3,4-diamine CAS Name: N4-[[4-(1H-indol-3-ylsulfonyl)phenyl]methyl]pyridine-3,4-diamine IUPAC Name: 4-N-[[4-(1H-indol-3-ylsulfonyl)phenyl]methyl]pyridine-3,4-diamine Traditional Name: (3-amino-4-pyridyl)-[4-(1H-indol-3-ylsulfonyl)benzyl]amine Formula: C20H18N4O2S MolecularWeight: 378.44752

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)S(=O)(=O)C3=CC=C(C=C3)CNC4=C(C=NC=C4)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)S(=O)(=O)C3=CC=C(C=C3)CNC4=C(C=NC=C4)N

InChI

InChI=1S/C20H18N4O2S/c21-17-12-22-10-9-19(17)23-11-14-5-7-15(8-6-14)27(25,26)20-13-24-18-4-2-1-3-16(18)20/h1-10,12-13,24H,11,21H2,(H,22,23)