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

Systemtic Name: 1-[5-(7-bromanyl-5,6-dimethyl-1,3-benzoxazol-2-yl)-2-methoxy-phenyl]thiourea Openeye Name: [5-(7-bromo-5,6-dimethyl-1,3-benzoxazol-2-yl)-2-methoxy-phenyl]thiourea CAS Name: [5-(7-bromo-5,6-dimethyl-1,3-benzoxazol-2-yl)-2-methoxyphenyl]thiourea IUPAC Name: [5-(7-bromo-5,6-dimethyl-1,3-benzoxazol-2-yl)-2-methoxyphenyl]thiourea Traditional Name: [5-(7-bromo-5,6-dimethyl-1,3-benzoxazol-2-yl)-2-methoxy-phenyl]thiourea Formula: C17H16BrN3O2S MolecularWeight: 406.29684

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16BrN3O2S/c1-8-6-12-15(14(18)9(8)2)23-16(20-12)10-4-5-13(22-3)11(7-10)21-17(19)24/h4-7H,1-3H3,(H3,19,21,24)