1-(1,3-benzothiazol-2-ylmethyl)-3-(3-bromophenyl)-1-methyl-thiourea

Systemtic Name: 1-(1,3-benzothiazol-2-ylmethyl)-3-(3-bromophenyl)-1-methyl-thiourea Openeye Name: 1-(1,3-benzothiazol-2-ylmethyl)-3-(3-bromophenyl)-1-methyl-thiourea CAS Name: 1-(1,3-benzothiazol-2-ylmethyl)-3-(3-bromophenyl)-1-methylthiourea IUPAC Name: 1-(1,3-benzothiazol-2-ylmethyl)-3-(3-bromophenyl)-1-methylthiourea Traditional Name: 1-(1,3-benzothiazol-2-ylmethyl)-3-(3-bromophenyl)-1-methyl-thiourea Formula: C16H14BrN3S2 MolecularWeight: 392.33646

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC2=CC=CC=C2S1)C(=S)NC3=CC(=CC=C3)Br

Isomeric SMILES

CN(CC1=NC2=CC=CC=C2S1)C(=S)NC3=CC(=CC=C3)Br

InChI

InChI=1S/C16H14BrN3S2/c1-20(16(21)18-12-6-4-5-11(17)9-12)10-15-19-13-7-2-3-8-14(13)22-15/h2-9H,10H2,1H3,(H,18,21)