6-[2-methylimino-3-[1-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)propylamino]-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[2-methylimino-3-[1-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)propylamino]-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-methylimino-3-[1-(4-oxocyclohexa-2,5-dien-1-ylidene)propylamino]thiazol-4-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[2-methylimino-3-[1-(4-oxo-1-cyclohexa-2,5-dienylidene)propylamino]-4-thiazolyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[2-methylimino-3-[1-(4-oxocyclohexa-2,5-dien-1-ylidene)propylamino]-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[3-[1-(4-ketocyclohexa-2,5-dien-1-ylidene)propylamino]-2-methylimino-4-thiazolin-4-yl]-4H-1,4-benzoxazin-3-one Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C1C=CC(=O)C=C1)NN2C(=CSC2=NC)C3=CC4=C(C=C3)OCC(=O)N4

Isomeric SMILES

CCC(=C1C=CC(=O)C=C1)NN2C(=CSC2=NC)C3=CC4=C(C=C3)OCC(=O)N4

InChI

InChI=1S/C21H20N4O3S/c1-3-16(13-4-7-15(26)8-5-13)24-25-18(12-29-21(25)22-2)14-6-9-19-17(10-14)23-20(27)11-28-19/h4-10,12,24H,3,11H2,1-2H3,(H,23,27)