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

Systemtic Name: 1-[4-(7-bromanyl-5,6-dimethyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]thiourea Openeye Name: [4-(7-bromo-5,6-dimethyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]thiourea CAS Name: [4-(7-bromo-5,6-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]thiourea IUPAC Name: [4-(7-bromo-5,6-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]thiourea Traditional Name: [4-(7-bromo-5,6-dimethyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]thiourea Formula: C17H16BrN3OS MolecularWeight: 390.29744

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16BrN3OS/c1-8-7-13-15(14(18)10(8)3)22-16(20-13)11-4-5-12(9(2)6-11)21-17(19)23/h4-7H,1-3H3,(H3,19,21,23)