N-[3-[[(2S)-2-azanylpropanoyl]amino]-2-oxidanyl-propyl]-2-(3-chloranyl-4-pyrrol-1-yl-phenyl)propanamide

Systemtic Name: N-[3-[[(2S)-2-azanylpropanoyl]amino]-2-oxidanyl-propyl]-2-(3-chloranyl-4-pyrrol-1-yl-phenyl)propanamide Openeye Name: N-[3-[[(2S)-2-aminopropanoyl]amino]-2-hydroxy-propyl]-2-(3-chloro-4-pyrrol-1-yl-phenyl)propanamide CAS Name: N-[3-[[(2S)-2-amino-1-oxopropyl]amino]-2-hydroxypropyl]-2-[3-chloro-4-(1-pyrrolyl)phenyl]propanamide IUPAC Name: N-[3-[[(2S)-2-aminopropanoyl]amino]-2-hydroxypropyl]-2-(3-chloro-4-pyrrol-1-ylphenyl)propanamide Traditional Name: N-[3-[[(2S)-2-aminopropanoyl]amino]-2-hydroxy-propyl]-2-(3-chloro-4-pyrrol-1-yl-phenyl)propionamide Formula: C19H25ClN4O3 MolecularWeight: 392.8798

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)N2C=CC=C2)Cl)C(=O)NCC(CNC(=O)C(C)N)O

Isomeric SMILES

C[C@@H](C(=O)NCC(CNC(=O)C(C)C1=CC(=C(C=C1)N2C=CC=C2)Cl)O)N

InChI

InChI=1S/C19H25ClN4O3/c1-12(18(26)22-10-15(25)11-23-19(27)13(2)21)14-5-6-17(16(20)9-14)24-7-3-4-8-24/h3-9,12-13,15,25H,10-11,21H2,1-2H3,(H,22,26)(H,23,27)/t12?,13-,15?/m0/s1