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(4S)-4-azanyl-N-(4-phenoxyphenyl)-4-(1H-1,2,4-triazol-5-yl)butanamide

(4S)-4-azanyl-N-(4-phenoxyphenyl)-4-(1H-1,2,4-triazol-5-yl)butanamide

Systemtic Name:(4S)-4-azanyl-N-(4-phenoxyphenyl)-4-(1H-1,2,4-triazol-5-yl)butanamide
Openeye Name:(4S)-4-amino-N-(4-phenoxyphenyl)-4-(1H-1,2,4-triazol-5-yl)butanamide
CAS Name:(4S)-4-amino-N-(4-phenoxyphenyl)-4-(1H-1,2,4-triazol-5-yl)butanamide
IUPAC Name:(4S)-4-amino-N-(4-phenoxyphenyl)-4-(1H-1,2,4-triazol-5-yl)butanamide
Traditional Name:(4S)-4-amino-N-(4-phenoxyphenyl)-4-(1H-1,2,4-triazol-5-yl)butyramide
Formula: C18H19N5O2
MolecularWeight: 337.37576
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CCC(C3=NC=NN3)N


Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CC[C@@H](C3=NC=NN3)N


InChI

InChI=1S/C18H19N5O2/c19-16(18-20-12-21-23-18)10-11-17(24)22-13-6-8-15(9-7-13)25-14-4-2-1-3-5-14/h1-9,12,16H,10-11,19H2,(H,22,24)(H,20,21,23)/t16-/m0/s1


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