3,4,5-triethoxy-N-[5-[(phenylmethyl)amino]-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 3,4,5-triethoxy-N-[5-[(phenylmethyl)amino]-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: N-[5-(benzylamino)-1,3,4-thiadiazol-2-yl]-3,4,5-triethoxy-benzamide CAS Name: 3,4,5-triethoxy-N-[5-[(phenylmethyl)amino]-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: N-[5-(benzylamino)-1,3,4-thiadiazol-2-yl]-3,4,5-triethoxybenzamide Traditional Name: N-[5-(benzylamino)-1,3,4-thiadiazol-2-yl]-3,4,5-triethoxy-benzamide Formula: C22H26N4O4S MolecularWeight: 442.53124

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=NN=C(S2)NCC3=CC=CC=C3

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=NN=C(S2)NCC3=CC=CC=C3

InChI

InChI=1S/C22H26N4O4S/c1-4-28-17-12-16(13-18(29-5-2)19(17)30-6-3)20(27)24-22-26-25-21(31-22)23-14-15-10-8-7-9-11-15/h7-13H,4-6,14H2,1-3H3,(H,23,25)(H,24,26,27)