1-(3-bromophenyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-(3-bromophenyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-1,2,3-triazole-4-carboxamide Openeye Name: 1-(3-bromophenyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)triazole-4-carboxamide CAS Name: 1-(3-bromophenyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-triazolecarboxamide IUPAC Name: 1-(3-bromophenyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)triazole-4-carboxamide Traditional Name: 1-(3-bromophenyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)triazole-4-carboxamide Formula: C18H14BrN5O2S MolecularWeight: 444.30506

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CN(N=N3)C4=CC(=CC=C4)Br

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CN(N=N3)C4=CC(=CC=C4)Br

InChI

InChI=1S/C18H14BrN5O2S/c1-2-26-13-6-7-14-16(9-13)27-18(20-14)21-17(25)15-10-24(23-22-15)12-5-3-4-11(19)8-12/h3-10H,2H2,1H3,(H,20,21,25)