2-phenyl-2-[[5-[(phenylmethyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-phenyl-2-[[5-[(phenylmethyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[[5-(benzylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-2-phenyl-1-pyrrolidin-1-yl-ethanone CAS Name: 2-phenyl-2-[[5-[(phenylmethyl)amino]-1,3,4-thiadiazol-2-yl]thio]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[[5-(benzylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-2-phenyl-1-pyrrolidin-1-ylethanone Traditional Name: 2-[[5-(benzylamino)-1,3,4-thiadiazol-2-yl]thio]-2-phenyl-1-pyrrolidino-ethanone Formula: C21H22N4OS2 MolecularWeight: 410.55558

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C(C2=CC=CC=C2)SC3=NN=C(S3)NCC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C(=O)C(C2=CC=CC=C2)SC3=NN=C(S3)NCC4=CC=CC=C4

InChI

InChI=1S/C21H22N4OS2/c26-19(25-13-7-8-14-25)18(17-11-5-2-6-12-17)27-21-24-23-20(28-21)22-15-16-9-3-1-4-10-16/h1-6,9-12,18H,7-8,13-15H2,(H,22,23)