(2S)-2-azanyl-4-methyl-N-[4-[4-[(3-pyrrolidin-1-ylpropylamino)methyl]phenyl]thiophen-3-yl]pentanamide

Systemtic Name: (2S)-2-azanyl-4-methyl-N-[4-[4-[(3-pyrrolidin-1-ylpropylamino)methyl]phenyl]thiophen-3-yl]pentanamide Openeye Name: (2S)-2-amino-4-methyl-N-[4-[4-[(3-pyrrolidin-1-ylpropylamino)methyl]phenyl]-3-thienyl]pentanamide CAS Name: (2S)-2-amino-4-methyl-N-[4-[4-[[3-(1-pyrrolidinyl)propylamino]methyl]phenyl]-3-thiophenyl]pentanamide IUPAC Name: (2S)-2-amino-4-methyl-N-[4-[4-[(3-pyrrolidin-1-ylpropylamino)methyl]phenyl]thiophen-3-yl]pentanamide Traditional Name: (2S)-2-amino-4-methyl-N-[4-[4-[(3-pyrrolidinopropylamino)methyl]phenyl]-3-thienyl]valeramide Formula: C24H36N4OS MolecularWeight: 428.63384

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1=CSC=C1C2=CC=C(C=C2)CNCCCN3CCCC3)N

Isomeric SMILES

CC(C)C[C@@H](C(=O)NC1=CSC=C1C2=CC=C(C=C2)CNCCCN3CCCC3)N

InChI

InChI=1S/C24H36N4OS/c1-18(2)14-22(25)24(29)27-23-17-30-16-21(23)20-8-6-19(7-9-20)15-26-10-5-13-28-11-3-4-12-28/h6-9,16-18,22,26H,3-5,10-15,25H2,1-2H3,(H,27,29)/t22-/m0/s1