3-(2-azanyl-2-oxidanylidene-ethyl)-4-(2,3-dihydro-1H-inden-2-yl)-4-(2-imidazol-1-ylpyrimidin-4-yl)-N-propyl-piperazin-4-ium-1-carboxamide

Systemtic Name: 3-(2-azanyl-2-oxidanylidene-ethyl)-4-(2,3-dihydro-1H-inden-2-yl)-4-(2-imidazol-1-ylpyrimidin-4-yl)-N-propyl-piperazin-4-ium-1-carboxamide Openeye Name: 3-(2-amino-2-oxo-ethyl)-4-(2-imidazol-1-ylpyrimidin-4-yl)-4-indan-2-yl-N-propyl-piperazin-4-ium-1-carboxamide CAS Name: 3-(2-amino-2-oxoethyl)-4-(2,3-dihydro-1H-inden-2-yl)-4-[2-(1-imidazolyl)-4-pyrimidinyl]-N-propyl-1-piperazin-4-iumcarboxamide IUPAC Name: 3-(2-amino-2-oxoethyl)-4-(2,3-dihydro-1H-inden-2-yl)-4-(2-imidazol-1-ylpyrimidin-4-yl)-N-propylpiperazin-4-ium-1-carboxamide Traditional Name: 3-(2-amino-2-keto-ethyl)-4-(2-imidazol-1-ylpyrimidin-4-yl)-4-indan-2-yl-N-propyl-piperazin-4-ium-1-carboxamide Formula: C26H33N8O2+ MolecularWeight: 489.59262

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)N1CC[N+](C(C1)CC(=O)N)(C2CC3=CC=CC=C3C2)C4=NC(=NC=C4)N5C=CN=C5

Isomeric SMILES

CCCNC(=O)N1CC[N+](C(C1)CC(=O)N)(C2CC3=CC=CC=C3C2)C4=NC(=NC=C4)N5C=CN=C5

InChI

InChI=1S/C26H32N8O2/c1-2-8-30-26(36)32-12-13-34(22(17-32)16-23(27)35,21-14-19-5-3-4-6-20(19)15-21)24-7-9-29-25(31-24)33-11-10-28-18-33/h3-7,9-11,18,21-22H,2,8,12-17H2,1H3,(H2-,27,30,35,36)/p+1