1-[2-chloranyl-4-(cyclohexa-1,5-dien-1-ylcarbamothioylamino)phenyl]-1-methyl-urea

Systemtic Name: 1-[2-chloranyl-4-(cyclohexa-1,5-dien-1-ylcarbamothioylamino)phenyl]-1-methyl-urea Openeye Name: 1-[2-chloro-4-(cyclohexa-1,5-dien-1-ylcarbamothioylamino)phenyl]-1-methyl-urea CAS Name: 1-[2-chloro-4-[[(1-cyclohexa-1,5-dienylamino)-sulfanylidenemethyl]amino]phenyl]-1-methylurea IUPAC Name: 1-[2-chloro-4-(cyclohexa-1,5-dien-1-ylcarbamothioylamino)phenyl]-1-methylurea Traditional Name: 1-[2-chloro-4-(cyclohexa-1,5-dien-1-ylthiocarbamoylamino)phenyl]-1-methyl-urea Formula: C15H17ClN4OS MolecularWeight: 336.83968

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=C(C=C(C=C1)NC(=S)NC2=CCCC=C2)Cl)C(=O)N

Isomeric SMILES

CN(C1=C(C=C(C=C1)NC(=S)NC2=CCCC=C2)Cl)C(=O)N

InChI

InChI=1S/C15H17ClN4OS/c1-20(14(17)21)13-8-7-11(9-12(13)16)19-15(22)18-10-5-3-2-4-6-10/h3,5-9H,2,4H2,1H3,(H2,17,21)(H2,18,19,22)