1-(6-chloranyl-1,3-benzothiazol-2-yl)-3-[1-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)ethylamino]thiourea

Systemtic Name: 1-(6-chloranyl-1,3-benzothiazol-2-yl)-3-[1-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)ethylamino]thiourea Openeye Name: 1-(6-chloro-1,3-benzothiazol-2-yl)-3-[1-(4-oxocyclohexa-2,5-dien-1-ylidene)ethylamino]thiourea CAS Name: 1-(6-chloro-1,3-benzothiazol-2-yl)-3-[1-(4-oxo-1-cyclohexa-2,5-dienylidene)ethylamino]thiourea IUPAC Name: 1-(6-chloro-1,3-benzothiazol-2-yl)-3-[1-(4-oxocyclohexa-2,5-dien-1-ylidene)ethylamino]thiourea Traditional Name: 1-(6-chloro-1,3-benzothiazol-2-yl)-3-[1-(4-ketocyclohexa-2,5-dien-1-ylidene)ethylamino]thiourea Formula: C16H13ClN4OS2 MolecularWeight: 376.88362

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C=CC(=O)C=C1)NNC(=S)NC2=NC3=C(S2)C=C(C=C3)Cl

Isomeric SMILES

CC(=C1C=CC(=O)C=C1)NNC(=S)NC2=NC3=C(S2)C=C(C=C3)Cl

InChI

InChI=1S/C16H13ClN4OS2/c1-9(10-2-5-12(22)6-3-10)20-21-15(23)19-16-18-13-7-4-11(17)8-14(13)24-16/h2-8,20H,1H3,(H2,18,19,21,23)