3-(5-azanylpentyl)-1-(1H-indol-3-ylmethyl)-5-[(5-phenyl-1H-imidazol-2-yl)methyl]-2-sulfanylidene-imidazolidin-4-one

Systemtic Name: 3-(5-azanylpentyl)-1-(1H-indol-3-ylmethyl)-5-[(5-phenyl-1H-imidazol-2-yl)methyl]-2-sulfanylidene-imidazolidin-4-one Openeye Name: 3-(5-aminopentyl)-1-(1H-indol-3-ylmethyl)-5-[(5-phenyl-1H-imidazol-2-yl)methyl]-2-thioxo-imidazolidin-4-one CAS Name: 3-(5-aminopentyl)-1-(1H-indol-3-ylmethyl)-5-[(5-phenyl-1H-imidazol-2-yl)methyl]-2-sulfanylidene-4-imidazolidinone IUPAC Name: 3-(5-aminopentyl)-1-(1H-indol-3-ylmethyl)-5-[(5-phenyl-1H-imidazol-2-yl)methyl]-2-sulfanylideneimidazolidin-4-one Traditional Name: 3-(5-aminopentyl)-1-(1H-indol-3-ylmethyl)-5-[(5-phenyl-1H-imidazol-2-yl)methyl]-2-thioxo-4-imidazolidinone Formula: C27H30N6OS MolecularWeight: 486.6317

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CN=C(N2)CC3C(=O)N(C(=S)N3CC4=CNC5=CC=CC=C54)CCCCCN

Isomeric SMILES

C1=CC=C(C=C1)C2=CN=C(N2)CC3C(=O)N(C(=S)N3CC4=CNC5=CC=CC=C54)CCCCCN

InChI

InChI=1S/C27H30N6OS/c28-13-7-2-8-14-32-26(34)24(15-25-30-17-23(31-25)19-9-3-1-4-10-19)33(27(32)35)18-20-16-29-22-12-6-5-11-21(20)22/h1,3-6,9-12,16-17,24,29H,2,7-8,13-15,18,28H2,(H,30,31)