5-[(2,5-dimethyl-1H-pyrrol-3-yl)methylidene]-1-(3-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[(2,5-dimethyl-1H-pyrrol-3-yl)methylidene]-1-(3-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(2,5-dimethyl-1H-pyrrol-3-yl)methylene]-1-(3-methoxyphenyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(2,5-dimethyl-1H-pyrrol-3-yl)methylidene]-1-(3-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(2,5-dimethyl-1H-pyrrol-3-yl)methylidene]-1-(3-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[(2,5-dimethyl-1H-pyrrol-3-yl)methylene]-1-(3-methoxyphenyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1)C)C=C2C(=O)NC(=S)N(C2=O)C3=CC(=CC=C3)OC

Isomeric SMILES

CC1=CC(=C(N1)C)C=C2C(=O)NC(=S)N(C2=O)C3=CC(=CC=C3)OC

InChI

InChI=1S/C18H17N3O3S/c1-10-7-12(11(2)19-10)8-15-16(22)20-18(25)21(17(15)23)13-5-4-6-14(9-13)24-3/h4-9,19H,1-3H3,(H,20,22,25)