1-[2-[cyclobutyl-[(5-methyl-2-phenyl-1,3-thiazol-4-yl)methyl]amino]ethanoyl]pyrrolidine-2-carbonitrile

Systemtic Name: 1-[2-[cyclobutyl-[(5-methyl-2-phenyl-1,3-thiazol-4-yl)methyl]amino]ethanoyl]pyrrolidine-2-carbonitrile Openeye Name: 1-[2-[cyclobutyl-[(5-methyl-2-phenyl-thiazol-4-yl)methyl]amino]acetyl]pyrrolidine-2-carbonitrile CAS Name: 1-[2-[cyclobutyl-[(5-methyl-2-phenyl-4-thiazolyl)methyl]amino]-1-oxoethyl]-2-pyrrolidinecarbonitrile IUPAC Name: 1-[2-[cyclobutyl-[(5-methyl-2-phenyl-1,3-thiazol-4-yl)methyl]amino]acetyl]pyrrolidine-2-carbonitrile Traditional Name: 1-[2-[cyclobutyl-[(5-methyl-2-phenyl-thiazol-4-yl)methyl]amino]acetyl]pyrrolidine-2-carbonitrile Formula: C22H26N4OS MolecularWeight: 394.53304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)C2=CC=CC=C2)CN(CC(=O)N3CCCC3C#N)C4CCC4

Isomeric SMILES

CC1=C(N=C(S1)C2=CC=CC=C2)CN(CC(=O)N3CCCC3C#N)C4CCC4

InChI

InChI=1S/C22H26N4OS/c1-16-20(24-22(28-16)17-7-3-2-4-8-17)14-25(18-9-5-10-18)15-21(27)26-12-6-11-19(26)13-23/h2-4,7-8,18-19H,5-6,9-12,14-15H2,1H3