1-pyrrolidin-2-ylcarbonyl-4-sulfanylidene-3-(1,2,3,4-tetrahydronaphthalen-2-ylcarbonyl)pyrrolidine-2-carbonitrile

Systemtic Name: 1-pyrrolidin-2-ylcarbonyl-4-sulfanylidene-3-(1,2,3,4-tetrahydronaphthalen-2-ylcarbonyl)pyrrolidine-2-carbonitrile Openeye Name: 1-(pyrrolidine-2-carbonyl)-3-(tetralin-2-carbonyl)-4-thioxo-pyrrolidine-2-carbonitrile CAS Name: 1-[oxo(2-pyrrolidinyl)methyl]-3-[oxo(1,2,3,4-tetrahydronaphthalen-2-yl)methyl]-4-sulfanylidene-2-pyrrolidinecarbonitrile IUPAC Name: 1-(pyrrolidine-2-carbonyl)-4-sulfanylidene-3-(1,2,3,4-tetrahydronaphthalene-2-carbonyl)pyrrolidine-2-carbonitrile Traditional Name: 1-prolyl-3-(tetralin-2-carbonyl)-4-thioxo-pyrrolidine-2-carbonitrile Formula: C21H23N3O2S MolecularWeight: 381.49122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)C(=O)N2CC(=S)C(C2C#N)C(=O)C3CCC4=CC=CC=C4C3

Isomeric SMILES

C1CC(NC1)C(=O)N2CC(=S)C(C2C#N)C(=O)C3CCC4=CC=CC=C4C3

InChI

InChI=1S/C21H23N3O2S/c22-11-17-19(18(27)12-24(17)21(26)16-6-3-9-23-16)20(25)15-8-7-13-4-1-2-5-14(13)10-15/h1-2,4-5,15-17,19,23H,3,6-10,12H2