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

Systemtic Name: 1-(2-methylphenyl)-3-[(Z)-1-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)ethylideneamino]thiourea Openeye Name: 1-(o-tolyl)-3-[(Z)-1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethylideneamino]thiourea CAS Name: 1-(2-methylphenyl)-3-[(Z)-1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethylideneamino]thiourea IUPAC Name: 1-(2-methylphenyl)-3-[(Z)-1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethylideneamino]thiourea Traditional Name: 1-[(Z)-1-(3-keto-4H-1,4-benzoxazin-6-yl)ethylideneamino]-3-(o-tolyl)thiourea Formula: C18H18N4O2S MolecularWeight: 354.42612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)NN=C(C)C2=CC3=C(C=C2)OCC(=O)N3

Isomeric SMILES

CC1=CC=CC=C1NC(=S)N/N=C(/C)\C2=CC3=C(C=C2)OCC(=O)N3

InChI

InChI=1S/C18H18N4O2S/c1-11-5-3-4-6-14(11)20-18(25)22-21-12(2)13-7-8-16-15(9-13)19-17(23)10-24-16/h3-9H,10H2,1-2H3,(H,19,23)(H2,20,22,25)/b21-12-