3-methoxy-N-[5-(phenylcarbamothioylamino)-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 3-methoxy-N-[5-(phenylcarbamothioylamino)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 3-methoxy-N-[5-(phenylcarbamothioylamino)-1,3,4-thiadiazol-2-yl]benzamide CAS Name: N-[5-[[anilino(sulfanylidene)methyl]amino]-1,3,4-thiadiazol-2-yl]-3-methoxybenzamide IUPAC Name: 3-methoxy-N-[5-(phenylcarbamothioylamino)-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 3-methoxy-N-[5-(phenylthiocarbamoylamino)-1,3,4-thiadiazol-2-yl]benzamide Formula: C17H15N5O2S2 MolecularWeight: 385.4633

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)NC2=NN=C(S2)NC(=S)NC3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)NC2=NN=C(S2)NC(=S)NC3=CC=CC=C3

InChI

InChI=1S/C17H15N5O2S2/c1-24-13-9-5-6-11(10-13)14(23)19-16-21-22-17(26-16)20-15(25)18-12-7-3-2-4-8-12/h2-10H,1H3,(H,19,21,23)(H2,18,20,22,25)