4-azanyl-3-[(3,5-dimethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-8-ethoxy-pyrimido[2,1-b][1,3]benzothiazol-2-one

Systemtic Name: 4-azanyl-3-[(3,5-dimethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-8-ethoxy-pyrimido[2,1-b][1,3]benzothiazol-2-one Openeye Name: 4-amino-3-[(3,5-dimethoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]-8-ethoxy-pyrimido[2,1-b][1,3]benzothiazol-2-one CAS Name: 4-amino-3-[(3,5-dimethoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-8-ethoxy-2-pyrimido[2,1-b][1,3]benzothiazolone IUPAC Name: 4-amino-3-[(3,5-dimethoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-8-ethoxypyrimido[2,1-b][1,3]benzothiazol-2-one Traditional Name: 4-amino-8-ethoxy-3-[(4-keto-3,5-dimethoxy-cyclohexa-2,5-dien-1-ylidene)methyl]pyrimido[2,1-b][1,3]benzothiazol-2-one Formula: C21H19N3O5S MolecularWeight: 425.45766

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N3C(=C(C(=O)N=C3S2)C=C4C=C(C(=O)C(=C4)OC)OC)N

Isomeric SMILES

CCOC1=CC2=C(C=C1)N3C(=C(C(=O)N=C3S2)C=C4C=C(C(=O)C(=C4)OC)OC)N

InChI

InChI=1S/C21H19N3O5S/c1-4-29-12-5-6-14-17(10-12)30-21-23-20(26)13(19(22)24(14)21)7-11-8-15(27-2)18(25)16(9-11)28-3/h5-10H,4,22H2,1-3H3