N-methyl-3-phenylmethoxy-2-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)carbamoylamino]butanamide

Systemtic Name: N-methyl-3-phenylmethoxy-2-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)carbamoylamino]butanamide Openeye Name: 3-benzyloxy-N-methyl-2-[(2-thioxo-3H-1,3,4-thiadiazol-5-yl)carbamoylamino]butanamide CAS Name: N-methyl-2-[[oxo-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)amino]methyl]amino]-3-phenylmethoxybutanamide IUPAC Name: N-methyl-3-phenylmethoxy-2-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)carbamoylamino]butanamide Traditional Name: 3-benzoxy-N-methyl-2-[(2-thioxo-3H-1,3,4-thiadiazol-5-yl)carbamoylamino]butyramide Formula: C15H19N5O3S2 MolecularWeight: 381.47306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)NC)NC(=O)NC1=NNC(=S)S1)OCC2=CC=CC=C2

Isomeric SMILES

CC(C(C(=O)NC)NC(=O)NC1=NNC(=S)S1)OCC2=CC=CC=C2

InChI

InChI=1S/C15H19N5O3S2/c1-9(23-8-10-6-4-3-5-7-10)11(12(21)16-2)17-13(22)18-14-19-20-15(24)25-14/h3-7,9,11H,8H2,1-2H3,(H,16,21)(H,20,24)(H2,17,18,19,22)