4-(2-cyanoethyl)-3-(5-cyanothiophen-2-yl)-5-(5-methylhexyl)-1-(thiophen-2-ylmethylamino)pyrrolidine-3-carbonitrile

Systemtic Name: 4-(2-cyanoethyl)-3-(5-cyanothiophen-2-yl)-5-(5-methylhexyl)-1-(thiophen-2-ylmethylamino)pyrrolidine-3-carbonitrile Openeye Name: 4-(2-cyanoethyl)-3-(5-cyano-2-thienyl)-5-(5-methylhexyl)-1-(2-thienylmethylamino)pyrrolidine-3-carbonitrile CAS Name: 4-(2-cyanoethyl)-3-(5-cyano-2-thiophenyl)-5-(5-methylhexyl)-1-(thiophen-2-ylmethylamino)-3-pyrrolidinecarbonitrile IUPAC Name: 4-(2-cyanoethyl)-3-(5-cyanothiophen-2-yl)-5-(5-methylhexyl)-1-(thiophen-2-ylmethylamino)pyrrolidine-3-carbonitrile Traditional Name: 4-(2-cyanoethyl)-3-(5-cyano-2-thienyl)-5-(5-methylhexyl)-1-(2-thenylamino)pyrrolidine-3-carbonitrile Formula: C25H31N5S2 MolecularWeight: 465.67714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCC1C(C(CN1NCC2=CC=CS2)(C#N)C3=CC=C(S3)C#N)CCC#N

Isomeric SMILES

CC(C)CCCCC1C(C(CN1NCC2=CC=CS2)(C#N)C3=CC=C(S3)C#N)CCC#N

InChI

InChI=1S/C25H31N5S2/c1-19(2)7-3-4-10-23-22(9-5-13-26)25(17-28,24-12-11-20(15-27)32-24)18-30(23)29-16-21-8-6-14-31-21/h6,8,11-12,14,19,22-23,29H,3-5,7,9-10,16,18H2,1-2H3