4-[[5-[[cyclohexylmethyl-(2-thiomorpholin-4-ylcarbonyl-1-benzothiophen-4-yl)amino]methyl]imidazol-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[5-[[cyclohexylmethyl-(2-thiomorpholin-4-ylcarbonyl-1-benzothiophen-4-yl)amino]methyl]imidazol-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[5-[[cyclohexylmethyl-[2-(thiomorpholine-4-carbonyl)benzothiophen-4-yl]amino]methyl]imidazol-1-yl]methyl]benzonitrile CAS Name: 4-[[5-[[cyclohexylmethyl-[2-[oxo(thiomorpholin-4-yl)methyl]-1-benzothiophen-4-yl]amino]methyl]-1-imidazolyl]methyl]benzonitrile IUPAC Name: 4-[[5-[[cyclohexylmethyl-[2-(thiomorpholine-4-carbonyl)-1-benzothiophen-4-yl]amino]methyl]imidazol-1-yl]methyl]benzonitrile Traditional Name: 4-[[5-[[cyclohexylmethyl-[2-(thiomorpholine-4-carbonyl)benzothiophen-4-yl]amino]methyl]imidazol-1-yl]methyl]benzonitrile Formula: C32H35N5OS2 MolecularWeight: 569.7832

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN(CC2=CN=CN2CC3=CC=C(C=C3)C#N)C4=C5C=C(SC5=CC=C4)C(=O)N6CCSCC6

Isomeric SMILES

C1CCC(CC1)CN(CC2=CN=CN2CC3=CC=C(C=C3)C#N)C4=C5C=C(SC5=CC=C4)C(=O)N6CCSCC6

InChI

InChI=1S/C32H35N5OS2/c33-18-24-9-11-26(12-10-24)21-37-23-34-19-27(37)22-36(20-25-5-2-1-3-6-25)29-7-4-8-30-28(29)17-31(40-30)32(38)35-13-15-39-16-14-35/h4,7-12,17,19,23,25H,1-3,5-6,13-16,20-22H2