1-[(E)-(6-chloranyl-4-oxidanylidene-chromen-3-yl)methylideneamino]-3-ethyl-thiourea

Systemtic Name: 1-[(E)-(6-chloranyl-4-oxidanylidene-chromen-3-yl)methylideneamino]-3-ethyl-thiourea Openeye Name: 1-[(E)-(6-chloro-4-oxo-chromen-3-yl)methyleneamino]-3-ethyl-thiourea CAS Name: 1-[(E)-(6-chloro-4-oxo-1-benzopyran-3-yl)methylideneamino]-3-ethylthiourea IUPAC Name: 1-[(E)-(6-chloro-4-oxochromen-3-yl)methylideneamino]-3-ethylthiourea Traditional Name: 1-[(E)-(6-chloro-4-keto-chromen-3-yl)methyleneamino]-3-ethyl-thiourea Formula: C13H12ClN3O2S MolecularWeight: 309.77128

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NN=CC1=COC2=C(C1=O)C=C(C=C2)Cl

Isomeric SMILES

CCNC(=S)N/N=C/C1=COC2=C(C1=O)C=C(C=C2)Cl

InChI

InChI=1S/C13H12ClN3O2S/c1-2-15-13(20)17-16-6-8-7-19-11-4-3-9(14)5-10(11)12(8)18/h3-7H,2H2,1H3,(H2,15,17,20)/b16-6+