4-(1,3-benzothiazol-2-yl)-N-(1H-1,2,4-triazol-5-yl)butanimidate

Systemtic Name: 4-(1,3-benzothiazol-2-yl)-N-(1H-1,2,4-triazol-5-yl)butanimidate Openeye Name: 4-(1,3-benzothiazol-2-yl)-N-(1H-1,2,4-triazol-5-yl)butanimidate CAS Name: 4-(1,3-benzothiazol-2-yl)-N-(1H-1,2,4-triazol-5-yl)butanimidate IUPAC Name: 4-(1,3-benzothiazol-2-yl)-N-(1H-1,2,4-triazol-5-yl)butanimidate Traditional Name: 4-(1,3-benzothiazol-2-yl)-N-(1H-1,2,4-triazol-5-yl)butyrimidate Formula: C13H12N5OS- MolecularWeight: 286.33228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CCCC(=NC3=NC=NN3)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CCCC(=NC3=NC=NN3)[O-]

InChI

InChI=1S/C13H13N5OS/c19-11(17-13-14-8-15-18-13)6-3-7-12-16-9-4-1-2-5-10(9)20-12/h1-2,4-5,8H,3,6-7H2,(H2,14,15,17,18,19)/p-1