1-[(3-chloranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-(2-methoxyphenyl)thiourea

Systemtic Name: 1-[(3-chloranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-(2-methoxyphenyl)thiourea Openeye Name: 1-[(3-chloro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-(2-methoxyphenyl)thiourea CAS Name: 1-[(3-chloro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-3-(2-methoxyphenyl)thiourea IUPAC Name: 1-[(3-chloro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-3-(2-methoxyphenyl)thiourea Traditional Name: 1-[(3-chloro-6-keto-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-(2-methoxyphenyl)thiourea Formula: C15H14ClN3O2S MolecularWeight: 335.80856

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=S)NNC=C2C=C(C=CC2=O)Cl

Isomeric SMILES

COC1=CC=CC=C1NC(=S)NNC=C2C=C(C=CC2=O)Cl

InChI

InChI=1S/C15H14ClN3O2S/c1-21-14-5-3-2-4-12(14)18-15(22)19-17-9-10-8-11(16)6-7-13(10)20/h2-9,17H,1H3,(H2,18,19,22)