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

Systemtic Name: 1-(2-ethyl-6-methyl-phenyl)-3-[(Z)-1-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)ethylideneamino]thiourea Openeye Name: 1-(2-ethyl-6-methyl-phenyl)-3-[(Z)-1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethylideneamino]thiourea CAS Name: 1-(2-ethyl-6-methylphenyl)-3-[(Z)-1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethylideneamino]thiourea IUPAC Name: 1-(2-ethyl-6-methylphenyl)-3-[(Z)-1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethylideneamino]thiourea Traditional Name: 1-(2-ethyl-6-methyl-phenyl)-3-[(Z)-1-(3-keto-4H-1,4-benzoxazin-6-yl)ethylideneamino]thiourea Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NN=C(C)C2=CC3=C(C=C2)OCC(=O)N3)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)N/N=C(/C)\C2=CC3=C(C=C2)OCC(=O)N3)C

InChI

InChI=1S/C20H22N4O2S/c1-4-14-7-5-6-12(2)19(14)22-20(27)24-23-13(3)15-8-9-17-16(10-15)21-18(25)11-26-17/h5-10H,4,11H2,1-3H3,(H,21,25)(H2,22,24,27)/b23-13-