N1,N4-bis(phenylmethyl)-1,4-diazepane-1,4-dicarbothioamide

Systemtic Name: N1,N4-bis(phenylmethyl)-1,4-diazepane-1,4-dicarbothioamide Openeye Name: N1,N4-dibenzyl-1,4-diazepane-1,4-dicarbothioamide CAS Name: N1,N4-bis(phenylmethyl)-1,4-diazepane-1,4-dicarbothioamide IUPAC Name: 1-N,4-N-dibenzyl-1,4-diazepane-1,4-dicarbothioamide Traditional Name: N,N'-dibenzyl-1,4-diazepane-1,4-dicarbothioamide Formula: C21H26N4S2 MolecularWeight: 398.58794

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=S)NCC2=CC=CC=C2)C(=S)NCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN(C1)C(=S)NCC2=CC=CC=C2)C(=S)NCC3=CC=CC=C3

InChI

InChI=1S/C21H26N4S2/c26-20(22-16-18-8-3-1-4-9-18)24-12-7-13-25(15-14-24)21(27)23-17-19-10-5-2-6-11-19/h1-6,8-11H,7,12-17H2,(H,22,26)(H,23,27)