1-(3-chloranyl-2-methyl-phenyl)-3-[(Z)-1-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)ethylideneamino]thiourea

Systemtic Name: 1-(3-chloranyl-2-methyl-phenyl)-3-[(Z)-1-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)ethylideneamino]thiourea Openeye Name: 1-(3-chloro-2-methyl-phenyl)-3-[(Z)-1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethylideneamino]thiourea CAS Name: 1-(3-chloro-2-methylphenyl)-3-[(Z)-1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethylideneamino]thiourea IUPAC Name: 1-(3-chloro-2-methylphenyl)-3-[(Z)-1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethylideneamino]thiourea Traditional Name: 1-(3-chloro-2-methyl-phenyl)-3-[(Z)-1-(3-keto-4H-1,4-benzoxazin-6-yl)ethylideneamino]thiourea Formula: C18H17ClN4O2S MolecularWeight: 388.87118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=S)NN=C(C)C2=CC3=C(C=C2)OCC(=O)N3

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=S)N/N=C(/C)\C2=CC3=C(C=C2)OCC(=O)N3

InChI

InChI=1S/C18H17ClN4O2S/c1-10-13(19)4-3-5-14(10)21-18(26)23-22-11(2)12-6-7-16-15(8-12)20-17(24)9-25-16/h3-8H,9H2,1-2H3,(H,20,24)(H2,21,23,26)/b22-11-