1-[(2R)-4-(6-acetamidoindol-1-yl)-1-oxidanyl-butan-2-yl]imidazole-4-carboxamide

Systemtic Name: 1-[(2R)-4-(6-acetamidoindol-1-yl)-1-oxidanyl-butan-2-yl]imidazole-4-carboxamide Openeye Name: 1-[(1R)-3-(6-acetamidoindol-1-yl)-1-(hydroxymethyl)propyl]imidazole-4-carboxamide CAS Name: 1-[(2R)-4-(6-acetamido-1-indolyl)-1-hydroxybutan-2-yl]-4-imidazolecarboxamide IUPAC Name: 1-[(2R)-4-(6-acetamidoindol-1-yl)-1-hydroxybutan-2-yl]imidazole-4-carboxamide Traditional Name: 1-[(1R)-3-(6-acetamidoindol-1-yl)-1-methylol-propyl]imidazole-4-carboxamide Formula: C18H21N5O3 MolecularWeight: 355.39104

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)C=CN2CCC(CO)N3C=C(N=C3)C(=O)N

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)C=CN2CC[C@H](CO)N3C=C(N=C3)C(=O)N

InChI

InChI=1S/C18H21N5O3/c1-12(25)21-14-3-2-13-4-6-22(17(13)8-14)7-5-15(10-24)23-9-16(18(19)26)20-11-23/h2-4,6,8-9,11,15,24H,5,7,10H2,1H3,(H2,19,26)(H,21,25)/t15-/m1/s1