1-hexyl-3-[2-methyl-4-[3-[(2S)-2-methylpyrrolidin-1-yl]pyrrolidin-1-yl]phenyl]urea

Systemtic Name: 1-hexyl-3-[2-methyl-4-[3-[(2S)-2-methylpyrrolidin-1-yl]pyrrolidin-1-yl]phenyl]urea Openeye Name: 1-hexyl-3-[2-methyl-4-[3-[(2S)-2-methylpyrrolidin-1-yl]pyrrolidin-1-yl]phenyl]urea CAS Name: 1-hexyl-3-[2-methyl-4-[3-[(2S)-2-methyl-1-pyrrolidinyl]-1-pyrrolidinyl]phenyl]urea IUPAC Name: 1-hexyl-3-[2-methyl-4-[3-[(2S)-2-methylpyrrolidin-1-yl]pyrrolidin-1-yl]phenyl]urea Traditional Name: 1-hexyl-3-[2-methyl-4-[3-[(2S)-2-methylpyrrolidino]pyrrolidino]phenyl]urea Formula: C23H38N4O MolecularWeight: 386.57402

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)NC1=C(C=C(C=C1)N2CCC(C2)N3CCCC3C)C

Isomeric SMILES

CCCCCCNC(=O)NC1=C(C=C(C=C1)N2CCC(C2)N3CCC[C@@H]3C)C

InChI

InChI=1S/C23H38N4O/c1-4-5-6-7-13-24-23(28)25-22-11-10-20(16-18(22)2)26-15-12-21(17-26)27-14-8-9-19(27)3/h10-11,16,19,21H,4-9,12-15,17H2,1-3H3,(H2,24,25,28)/t19-,21?/m0/s1