1-[(3-bromanyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-(2-methoxyphenyl)thiourea

Systemtic Name: 1-[(3-bromanyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-(2-methoxyphenyl)thiourea Openeye Name: 1-[(3-bromo-5-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-(2-methoxyphenyl)thiourea CAS Name: 1-[(3-bromo-5-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-3-(2-methoxyphenyl)thiourea IUPAC Name: 1-[(3-bromo-5-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-3-(2-methoxyphenyl)thiourea Traditional Name: 1-[(3-bromo-4-keto-5-methoxy-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-(2-methoxyphenyl)thiourea Formula: C16H16BrN3O3S MolecularWeight: 410.28554

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=S)NNC=C2C=C(C(=O)C(=C2)Br)OC

Isomeric SMILES

COC1=CC=CC=C1NC(=S)NNC=C2C=C(C(=O)C(=C2)Br)OC

InChI

InChI=1S/C16H16BrN3O3S/c1-22-13-6-4-3-5-12(13)19-16(24)20-18-9-10-7-11(17)15(21)14(8-10)23-2/h3-9,18H,1-2H3,(H2,19,20,24)