N-[(3S)-1-[3-(cyclohexylamino)pyrrolidin-1-yl]carbonylpyrrolidin-3-yl]-4-phenyl-benzamide

Systemtic Name: N-[(3S)-1-[3-(cyclohexylamino)pyrrolidin-1-yl]carbonylpyrrolidin-3-yl]-4-phenyl-benzamide Openeye Name: N-[(3S)-1-[3-(cyclohexylamino)pyrrolidine-1-carbonyl]pyrrolidin-3-yl]-4-phenyl-benzamide CAS Name: N-[(3S)-1-[[3-(cyclohexylamino)-1-pyrrolidinyl]-oxomethyl]-3-pyrrolidinyl]-4-phenylbenzamide IUPAC Name: N-[(3S)-1-[3-(cyclohexylamino)pyrrolidine-1-carbonyl]pyrrolidin-3-yl]-4-phenylbenzamide Traditional Name: N-[(3S)-1-[3-(cyclohexylamino)pyrrolidine-1-carbonyl]pyrrolidin-3-yl]-4-phenyl-benzamide Formula: C28H36N4O2 MolecularWeight: 460.61104

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2CCN(C2)C(=O)N3CCC(C3)NC(=O)C4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)NC2CCN(C2)C(=O)N3CC[C@@H](C3)NC(=O)C4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H36N4O2/c33-27(23-13-11-22(12-14-23)21-7-3-1-4-8-21)30-26-16-18-32(20-26)28(34)31-17-15-25(19-31)29-24-9-5-2-6-10-24/h1,3-4,7-8,11-14,24-26,29H,2,5-6,9-10,15-20H2,(H,30,33)/t25?,26-/m0/s1