2-azanylidene-N-phenyl-5-[(4-phenylpiperazin-1-yl)methyl]-1,3-oxazolidine-3-carbothioamide

Systemtic Name: 2-azanylidene-N-phenyl-5-[(4-phenylpiperazin-1-yl)methyl]-1,3-oxazolidine-3-carbothioamide Openeye Name: 2-imino-N-phenyl-5-[(4-phenylpiperazin-1-yl)methyl]oxazolidine-3-carbothioamide CAS Name: 2-imino-N-phenyl-5-[(4-phenyl-1-piperazinyl)methyl]-3-oxazolidinecarbothioamide IUPAC Name: 2-imino-N-phenyl-5-[(4-phenylpiperazin-1-yl)methyl]-1,3-oxazolidine-3-carbothioamide Traditional Name: 2-imino-N-phenyl-5-[(4-phenylpiperazino)methyl]oxazolidine-3-carbothioamide Formula: C21H25N5OS MolecularWeight: 395.5211

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2CN(C(=N)O2)C(=S)NC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2CN(C(=N)O2)C(=S)NC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H25N5OS/c22-20-26(21(28)23-17-7-3-1-4-8-17)16-19(27-20)15-24-11-13-25(14-12-24)18-9-5-2-6-10-18/h1-10,19,22H,11-16H2,(H,23,28)