2-ethanimidoyl-3-oxidanylidene-4-[[5-[(phenylmethyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]butanenitrile

Systemtic Name: 2-ethanimidoyl-3-oxidanylidene-4-[[5-[(phenylmethyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]butanenitrile Openeye Name: 4-[[5-(benzylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-2-ethanimidoyl-3-oxo-butanenitrile CAS Name: 2-(1-iminoethyl)-3-oxo-4-[[5-[(phenylmethyl)amino]-1,3,4-thiadiazol-2-yl]thio]butanenitrile IUPAC Name: 4-[[5-(benzylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-2-ethanimidoyl-3-oxobutanenitrile Traditional Name: 2-acetimidoyl-4-[[5-(benzylamino)-1,3,4-thiadiazol-2-yl]thio]-3-keto-butyronitrile Formula: C15H15N5OS2 MolecularWeight: 345.4425

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)CSC1=NN=C(S1)NCC2=CC=CC=C2

Isomeric SMILES

CC(=N)C(C#N)C(=O)CSC1=NN=C(S1)NCC2=CC=CC=C2

InChI

InChI=1S/C15H15N5OS2/c1-10(17)12(7-16)13(21)9-22-15-20-19-14(23-15)18-8-11-5-3-2-4-6-11/h2-6,12,17H,8-9H2,1H3,(H,18,19)