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

Systemtic Name: 1-[4-(7-bromanyl-5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]thiourea Openeye Name: [4-(7-bromo-5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]thiourea CAS Name: [4-(7-bromo-5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]thiourea IUPAC Name: [4-(7-bromo-5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]thiourea Traditional Name: [4-(7-bromo-5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]thiourea Formula: C16H14BrN3OS MolecularWeight: 376.27086

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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

Isomeric SMILES

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

InChI

InChI=1S/C16H14BrN3OS/c1-8-7-12-14(13(17)9(8)2)21-15(20-12)10-3-5-11(6-4-10)19-16(18)22/h3-7H,1-2H3,(H3,18,19,22)