(4R)-2-[7-(oxan-4-ylamino)-1H-indol-2-yl]-4,5-dihydro-1,3-thiazole-4-carboxylic acid

Systemtic Name: (4R)-2-[7-(oxan-4-ylamino)-1H-indol-2-yl]-4,5-dihydro-1,3-thiazole-4-carboxylic acid Openeye Name: (4R)-2-[7-(tetrahydropyran-4-ylamino)-1H-indol-2-yl]-4,5-dihydrothiazole-4-carboxylic acid CAS Name: (4R)-2-[7-(4-oxanylamino)-1H-indol-2-yl]-4,5-dihydrothiazole-4-carboxylic acid IUPAC Name: (4R)-2-[7-(oxan-4-ylamino)-1H-indol-2-yl]-4,5-dihydro-1,3-thiazole-4-carboxylic acid Traditional Name: (4R)-2-[7-(tetrahydropyran-4-ylamino)-1H-indol-2-yl]-2-thiazoline-4-carboxylic acid Formula: C17H19N3O3S MolecularWeight: 345.41606

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1NC2=CC=CC3=C2NC(=C3)C4=NC(CS4)C(=O)O

Isomeric SMILES

C1COCCC1NC2=CC=CC3=C2NC(=C3)C4=N[C@@H](CS4)C(=O)O

InChI

InChI=1S/C17H19N3O3S/c21-17(22)14-9-24-16(20-14)13-8-10-2-1-3-12(15(10)19-13)18-11-4-6-23-7-5-11/h1-3,8,11,14,18-19H,4-7,9H2,(H,21,22)/t14-/m0/s1