1,5-bis[(3-chlorophenyl)methyl]-4-sulfanylidene-1,3,5-triazepan-2-one

Systemtic Name: 1,5-bis[(3-chlorophenyl)methyl]-4-sulfanylidene-1,3,5-triazepan-2-one Openeye Name: 1,5-bis[(3-chlorophenyl)methyl]-4-thioxo-1,3,5-triazepan-2-one CAS Name: 1,5-bis[(3-chlorophenyl)methyl]-4-sulfanylidene-1,3,5-triazepan-2-one IUPAC Name: 1,5-bis[(3-chlorophenyl)methyl]-4-sulfanylidene-1,3,5-triazepan-2-one Traditional Name: 1,5-bis(3-chlorobenzyl)-4-thioxo-1,3,5-triazepan-2-one Formula: C18H17Cl2N3OS MolecularWeight: 394.31808

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=S)NC(=O)N1CC2=CC(=CC=C2)Cl)CC3=CC(=CC=C3)Cl

Isomeric SMILES

C1CN(C(=S)NC(=O)N1CC2=CC(=CC=C2)Cl)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H17Cl2N3OS/c19-15-5-1-3-13(9-15)11-22-7-8-23(18(25)21-17(22)24)12-14-4-2-6-16(20)10-14/h1-6,9-10H,7-8,11-12H2,(H,21,24,25)