2-[[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(phenylcarbamoyl)propanamide

Systemtic Name: 2-[[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(phenylcarbamoyl)propanamide Openeye Name: 2-[[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(phenylcarbamoyl)propanamide CAS Name: N-[anilino(oxo)methyl]-2-[[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]thio]propanamide IUPAC Name: 2-[[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(phenylcarbamoyl)propanamide Traditional Name: 2-[[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]thio]-N-(phenylcarbamoyl)propionamide Formula: C18H23N5O2S2 MolecularWeight: 405.53752

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC1=CC=CC=C1)SC2=NN=C(S2)NC3CCCCC3

Isomeric SMILES

CC(C(=O)NC(=O)NC1=CC=CC=C1)SC2=NN=C(S2)NC3CCCCC3

InChI

InChI=1S/C18H23N5O2S2/c1-12(15(24)21-16(25)19-13-8-4-2-5-9-13)26-18-23-22-17(27-18)20-14-10-6-3-7-11-14/h2,4-5,8-9,12,14H,3,6-7,10-11H2,1H3,(H,20,22)(H2,19,21,24,25)