3-[3-(5-azanyl-4,4-dimethyl-3-oxidanyl-2-oxidanylidene-pyrrol-3-yl)-3a,7a-dihydro-1,2-benzothiazol-5-yl]-1,6-dimethyl-pyrimidine-2,4-dione

Systemtic Name: 3-[3-(5-azanyl-4,4-dimethyl-3-oxidanyl-2-oxidanylidene-pyrrol-3-yl)-3a,7a-dihydro-1,2-benzothiazol-5-yl]-1,6-dimethyl-pyrimidine-2,4-dione Openeye Name: 3-[3-(5-amino-3-hydroxy-4,4-dimethyl-2-oxo-pyrrol-3-yl)-3a,7a-dihydro-1,2-benzothiazol-5-yl]-1,6-dimethyl-pyrimidine-2,4-dione CAS Name: 3-[3-(5-amino-3-hydroxy-4,4-dimethyl-2-oxo-3-pyrrolyl)-3a,7a-dihydro-1,2-benzothiazol-5-yl]-1,6-dimethylpyrimidine-2,4-dione IUPAC Name: 3-[3-(5-amino-3-hydroxy-4,4-dimethyl-2-oxopyrrol-3-yl)-3a,7a-dihydro-1,2-benzothiazol-5-yl]-1,6-dimethylpyrimidine-2,4-dione Traditional Name: 3-[3-(5-amino-3-hydroxy-2-keto-4,4-dimethyl-1-pyrrolin-3-yl)-3a,7a-dihydro-1,2-benzothiazol-5-yl]-1,6-dimethyl-pyrimidine-2,4-quinone Formula: C19H21N5O4S MolecularWeight: 415.46614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C(=O)N1C)C2=CC3C(C=C2)SN=C3C4(C(=O)N=C(C4(C)C)N)O

Isomeric SMILES

CC1=CC(=O)N(C(=O)N1C)C2=CC3C(C=C2)SN=C3C4(C(=O)N=C(C4(C)C)N)O

InChI

InChI=1S/C19H21N5O4S/c1-9-7-13(25)24(17(27)23(9)4)10-5-6-12-11(8-10)14(22-29-12)19(28)16(26)21-15(20)18(19,2)3/h5-8,11-12,28H,1-4H3,(H2,20,21,26)