(3S)-N-[4-(2-azanyl-1,3-thiazol-4-yl)phenyl]-3-(methylamino)-4-phenyl-butanamide

Systemtic Name: (3S)-N-[4-(2-azanyl-1,3-thiazol-4-yl)phenyl]-3-(methylamino)-4-phenyl-butanamide Openeye Name: (3S)-N-[4-(2-aminothiazol-4-yl)phenyl]-3-(methylamino)-4-phenyl-butanamide CAS Name: (3S)-N-[4-(2-amino-4-thiazolyl)phenyl]-3-(methylamino)-4-phenylbutanamide IUPAC Name: (3S)-N-[4-(2-amino-1,3-thiazol-4-yl)phenyl]-3-(methylamino)-4-phenylbutanamide Traditional Name: (3S)-N-[4-(2-aminothiazol-4-yl)phenyl]-3-(methylamino)-4-phenyl-butyramide Formula: C20H22N4OS MolecularWeight: 366.47988

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Descriptors Computed from Structure

Canonical SMILES:

CNC(CC1=CC=CC=C1)CC(=O)NC2=CC=C(C=C2)C3=CSC(=N3)N

Isomeric SMILES

CN[C@@H](CC1=CC=CC=C1)CC(=O)NC2=CC=C(C=C2)C3=CSC(=N3)N

InChI

InChI=1S/C20H22N4OS/c1-22-17(11-14-5-3-2-4-6-14)12-19(25)23-16-9-7-15(8-10-16)18-13-26-20(21)24-18/h2-10,13,17,22H,11-12H2,1H3,(H2,21,24)(H,23,25)/t17-/m0/s1