ethanoic acid; 2-methyl-3-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)amino]-5-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: ethanoic acid; 2-methyl-3-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)amino]-5-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: acetic acid; 2-methyl-3-[(4-oxocyclohexa-2,5-dien-1-ylidene)amino]-5-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: acetic acid; 2-methyl-3-[(4-oxo-1-cyclohexa-2,5-dienylidene)amino]-5-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: acetic acid; 2-methyl-3-[(4-oxocyclohexa-2,5-dien-1-ylidene)amino]-5-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: acetic acid; 3-[(4-ketocyclohexa-2,5-dien-1-ylidene)amino]-2-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C21H17N3O4S MolecularWeight: 407.44238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)N1N=C4C=CC(=O)C=C4.CC(=O)O

Isomeric SMILES

CC1=NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)N1N=C4C=CC(=O)C=C4.CC(=O)O

InChI

InChI=1S/C19H13N3O2S.C2H4O2/c1-12-20-18-17(16(11-25-18)13-5-3-2-4-6-13)19(24)22(12)21-14-7-9-15(23)10-8-14;1-2(3)4/h2-11H,1H3;1H3,(H,3,4)