(E)-3-(1,3-benzothiazol-2-yl)-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)prop-2-enamide

Systemtic Name: (E)-3-(1,3-benzothiazol-2-yl)-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)prop-2-enamide Openeye Name: (E)-3-(1,3-benzothiazol-2-yl)-N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]prop-2-enamide CAS Name: (E)-3-(1,3-benzothiazol-2-yl)-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)-2-propenamide IUPAC Name: (E)-3-(1,3-benzothiazol-2-yl)-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)prop-2-enamide Traditional Name: (E)-3-(1,3-benzothiazol-2-yl)-N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]acrylamide Formula: C17H18N4OS2 MolecularWeight: 358.48102

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=NN=C(S1)NC(=O)C=CC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCC(CC)C1=NN=C(S1)NC(=O)/C=C/C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H18N4OS2/c1-3-11(4-2)16-20-21-17(24-16)19-14(22)9-10-15-18-12-7-5-6-8-13(12)23-15/h5-11H,3-4H2,1-2H3,(H,19,21,22)/b10-9+