1-(1,2-benzoxazol-3-yl)-3-(3-chloranyl-4-methyl-phenyl)thiourea

Systemtic Name: 1-(1,2-benzoxazol-3-yl)-3-(3-chloranyl-4-methyl-phenyl)thiourea Openeye Name: 1-(1,2-benzoxazol-3-yl)-3-(3-chloro-4-methyl-phenyl)thiourea CAS Name: 1-(1,2-benzoxazol-3-yl)-3-(3-chloro-4-methylphenyl)thiourea IUPAC Name: 1-(1,2-benzoxazol-3-yl)-3-(3-chloro-4-methylphenyl)thiourea Traditional Name: 1-(3-chloro-4-methyl-phenyl)-3-indoxazen-3-yl-thiourea Formula: C15H12ClN3OS MolecularWeight: 317.79328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NC2=NOC3=CC=CC=C32)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NC2=NOC3=CC=CC=C32)Cl

InChI

InChI=1S/C15H12ClN3OS/c1-9-6-7-10(8-12(9)16)17-15(21)18-14-11-4-2-3-5-13(11)20-19-14/h2-8H,1H3,(H2,17,18,19,21)