5-[3-cyano-6-[3-(2-cyanoethylamino)pyrrolidin-1-yl]-2-methyl-hexan-3-yl]thiophene-2-carbonitrile

Systemtic Name: 5-[3-cyano-6-[3-(2-cyanoethylamino)pyrrolidin-1-yl]-2-methyl-hexan-3-yl]thiophene-2-carbonitrile Openeye Name: 5-[1-cyano-4-[3-(2-cyanoethylamino)pyrrolidin-1-yl]-1-isopropyl-butyl]thiophene-2-carbonitrile CAS Name: 5-[3-cyano-6-[3-(2-cyanoethylamino)-1-pyrrolidinyl]-2-methylhexan-3-yl]-2-thiophenecarbonitrile IUPAC Name: 5-[3-cyano-6-[3-(2-cyanoethylamino)pyrrolidin-1-yl]-2-methylhexan-3-yl]thiophene-2-carbonitrile Traditional Name: 5-[1-cyano-4-[3-(2-cyanoethylamino)pyrrolidino]-1-isopropyl-butyl]thiophene-2-carbonitrile Formula: C20H27N5S MolecularWeight: 369.52688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCN1CCC(C1)NCCC#N)(C#N)C2=CC=C(S2)C#N

Isomeric SMILES

CC(C)C(CCCN1CCC(C1)NCCC#N)(C#N)C2=CC=C(S2)C#N

InChI

InChI=1S/C20H27N5S/c1-16(2)20(15-23,19-6-5-18(13-22)26-19)8-3-11-25-12-7-17(14-25)24-10-4-9-21/h5-6,16-17,24H,3-4,7-8,10-12,14H2,1-2H3