(6Z)-6-[[[(1S)-1-naphthalen-1-ylethyl]amino]-oxidanyl-methylidene]-2-thiophen-2-yl-1H-pyrimidine-4,5-dione

Systemtic Name: (6Z)-6-[[[(1S)-1-naphthalen-1-ylethyl]amino]-oxidanyl-methylidene]-2-thiophen-2-yl-1H-pyrimidine-4,5-dione Openeye Name: (6Z)-6-[hydroxy-[[(1S)-1-(1-naphthyl)ethyl]amino]methylene]-2-(2-thienyl)-1H-pyrimidine-4,5-dione CAS Name: (6Z)-6-[hydroxy-[[(1S)-1-(1-naphthalenyl)ethyl]amino]methylidene]-2-thiophen-2-yl-1H-pyrimidine-4,5-dione IUPAC Name: (6Z)-6-[hydroxy-[[(1S)-1-naphthalen-1-ylethyl]amino]methylidene]-2-thiophen-2-yl-1H-pyrimidine-4,5-dione Traditional Name: (6Z)-6-[hydroxy-[[(1S)-1-(1-naphthyl)ethyl]amino]methylene]-2-(2-thienyl)-1H-pyrimidine-4,5-quinone Formula: C21H17N3O3S MolecularWeight: 391.44298

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)NC(=C3C(=O)C(=O)N=C(N3)C4=CC=CS4)O

Isomeric SMILES

C[C@@H](C1=CC=CC2=CC=CC=C21)N/C(=C/3\C(=O)C(=O)N=C(N3)C4=CC=CS4)/O

InChI

InChI=1S/C21H17N3O3S/c1-12(14-9-4-7-13-6-2-3-8-15(13)14)22-20(26)17-18(25)21(27)24-19(23-17)16-10-5-11-28-16/h2-12,22,26H,1H3,(H,23,24,27)/b20-17-/t12-/m0/s1