S-[[(3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]carbamoylamino] furan-2-carbothioate

Systemtic Name: S-[[(3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]carbamoylamino] furan-2-carbothioate Openeye Name: S-[[(3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-4-oxo-cyclohexa-1,5-dien-1-yl]carbamoylamino] furan-2-carbothioate CAS Name: 2-furancarbothioic acid S-[[[[(3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-4-oxo-1-cyclohexa-1,5-dienyl]amino]-oxomethyl]amino] ester IUPAC Name: S-[[(3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-4-oxocyclohexa-1,5-dien-1-yl]carbamoylamino] furan-2-carbothioate Traditional Name: furan-2-carbothioic acid S-[[(3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-4-keto-cyclohexa-1,5-dien-1-yl]carbamoylamino] ester Formula: C19H13N3O4S2 MolecularWeight: 411.45422

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=C3C=C(C=CC3=O)NC(=O)NSC(=O)C4=CC=CO4)S2

Isomeric SMILES

C1=CC=C2C(=C1)N/C(=C/3\C=C(C=CC3=O)NC(=O)NSC(=O)C4=CC=CO4)/S2

InChI

InChI=1S/C19H13N3O4S2/c23-14-8-7-11(20-19(25)22-28-18(24)15-5-3-9-26-15)10-12(14)17-21-13-4-1-2-6-16(13)27-17/h1-10,21H,(H2,20,22,25)/b17-12-