2-(3-azanyl-5-ethylsulfanyl-1,2,4-triazol-4-yl)-N-(6-methoxy-1,3-benzothiazol-2-yl)butanamide

Systemtic Name: 2-(3-azanyl-5-ethylsulfanyl-1,2,4-triazol-4-yl)-N-(6-methoxy-1,3-benzothiazol-2-yl)butanamide Openeye Name: 2-(3-amino-5-ethylsulfanyl-1,2,4-triazol-4-yl)-N-(6-methoxy-1,3-benzothiazol-2-yl)butanamide CAS Name: 2-[3-amino-5-(ethylthio)-1,2,4-triazol-4-yl]-N-(6-methoxy-1,3-benzothiazol-2-yl)butanamide IUPAC Name: 2-(3-amino-5-ethylsulfanyl-1,2,4-triazol-4-yl)-N-(6-methoxy-1,3-benzothiazol-2-yl)butanamide Traditional Name: 2-[3-amino-5-(ethylthio)-1,2,4-triazol-4-yl]-N-(6-methoxy-1,3-benzothiazol-2-yl)butyramide Formula: C16H20N6O2S2 MolecularWeight: 392.499

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC2=C(S1)C=C(C=C2)OC)N3C(=NN=C3SCC)N

Isomeric SMILES

CCC(C(=O)NC1=NC2=C(S1)C=C(C=C2)OC)N3C(=NN=C3SCC)N

InChI

InChI=1S/C16H20N6O2S2/c1-4-11(22-14(17)20-21-16(22)25-5-2)13(23)19-15-18-10-7-6-9(24-3)8-12(10)26-15/h6-8,11H,4-5H2,1-3H3,(H2,17,20)(H,18,19,23)