N-(pentan-3-ylideneamino)-4-[(5-phenyl-1,2,3,4-tetrazol-2-yl)methyl]benzamide

Systemtic Name: N-(pentan-3-ylideneamino)-4-[(5-phenyl-1,2,3,4-tetrazol-2-yl)methyl]benzamide Openeye Name: N-(1-ethylpropylideneamino)-4-[(5-phenyltetrazol-2-yl)methyl]benzamide CAS Name: N-(pentan-3-ylideneamino)-4-[(5-phenyl-2-tetrazolyl)methyl]benzamide IUPAC Name: N-(pentan-3-ylideneamino)-4-[(5-phenyltetrazol-2-yl)methyl]benzamide Traditional Name: N-(1-ethylpropylideneamino)-4-[(5-phenyltetrazol-2-yl)methyl]benzamide Formula: C20H22N6O MolecularWeight: 362.42828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=NNC(=O)C1=CC=C(C=C1)CN2N=C(N=N2)C3=CC=CC=C3)CC

Isomeric SMILES

CCC(=NNC(=O)C1=CC=C(C=C1)CN2N=C(N=N2)C3=CC=CC=C3)CC

InChI

InChI=1S/C20H22N6O/c1-3-18(4-2)21-23-20(27)17-12-10-15(11-13-17)14-26-24-19(22-25-26)16-8-6-5-7-9-16/h5-13H,3-4,14H2,1-2H3,(H,23,27)