N-[(1-carbamimidoylpiperidin-3-yl)methyl]-3-[2-[(4-nitrophenyl)sulfonylamino]-1H-indol-3-yl]propanamide

Systemtic Name: N-[(1-carbamimidoylpiperidin-3-yl)methyl]-3-[2-[(4-nitrophenyl)sulfonylamino]-1H-indol-3-yl]propanamide Openeye Name: N-[(1-carbamimidoyl-3-piperidyl)methyl]-3-[2-[(4-nitrophenyl)sulfonylamino]-1H-indol-3-yl]propanamide CAS Name: N-[(1-carbamimidoyl-3-piperidinyl)methyl]-3-[2-[(4-nitrophenyl)sulfonylamino]-1H-indol-3-yl]propanamide IUPAC Name: N-[(1-carbamimidoylpiperidin-3-yl)methyl]-3-[2-[(4-nitrophenyl)sulfonylamino]-1H-indol-3-yl]propanamide Traditional Name: N-[(1-amidino-3-piperidyl)methyl]-3-[2-(nosylamino)-1H-indol-3-yl]propionamide Formula: C24H29N7O5S MolecularWeight: 527.59596

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=N)N)CNC(=O)CCC2=C(NC3=CC=CC=C32)NS(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC(CN(C1)C(=N)N)CNC(=O)CCC2=C(NC3=CC=CC=C32)NS(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H29N7O5S/c25-24(26)30-13-3-4-16(15-30)14-27-22(32)12-11-20-19-5-1-2-6-21(19)28-23(20)29-37(35,36)18-9-7-17(8-10-18)31(33)34/h1-2,5-10,16,28-29H,3-4,11-15H2,(H3,25,26)(H,27,32)