1-[3-(7-bromanyl-5,6-dimethyl-1,3-benzoxazol-2-yl)-4-chloranyl-phenyl]thiourea

Systemtic Name: 1-[3-(7-bromanyl-5,6-dimethyl-1,3-benzoxazol-2-yl)-4-chloranyl-phenyl]thiourea Openeye Name: [3-(7-bromo-5,6-dimethyl-1,3-benzoxazol-2-yl)-4-chloro-phenyl]thiourea CAS Name: [3-(7-bromo-5,6-dimethyl-1,3-benzoxazol-2-yl)-4-chlorophenyl]thiourea IUPAC Name: [3-(7-bromo-5,6-dimethyl-1,3-benzoxazol-2-yl)-4-chlorophenyl]thiourea Traditional Name: [3-(7-bromo-5,6-dimethyl-1,3-benzoxazol-2-yl)-4-chloro-phenyl]thiourea Formula: C16H13BrClN3OS MolecularWeight: 410.71592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C1C)Br)OC(=N2)C3=C(C=CC(=C3)NC(=S)N)Cl

Isomeric SMILES

CC1=CC2=C(C(=C1C)Br)OC(=N2)C3=C(C=CC(=C3)NC(=S)N)Cl

InChI

InChI=1S/C16H13BrClN3OS/c1-7-5-12-14(13(17)8(7)2)22-15(21-12)10-6-9(20-16(19)23)3-4-11(10)18/h3-6H,1-2H3,(H3,19,20,23)