3-acetamido-N-[5-chloranyl-2-(1,2,4-triazol-1-yl)phenyl]-3-thiophen-2-yl-propanamide

Systemtic Name: 3-acetamido-N-[5-chloranyl-2-(1,2,4-triazol-1-yl)phenyl]-3-thiophen-2-yl-propanamide Openeye Name: 3-acetamido-N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-3-(2-thienyl)propanamide CAS Name: 3-acetamido-N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-3-thiophen-2-ylpropanamide IUPAC Name: 3-acetamido-N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-3-thiophen-2-ylpropanamide Traditional Name: 3-acetamido-N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-3-(2-thienyl)propionamide Formula: C17H16ClN5O2S MolecularWeight: 389.85924

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC(=O)NC1=C(C=CC(=C1)Cl)N2C=NC=N2)C3=CC=CS3

Isomeric SMILES

CC(=O)NC(CC(=O)NC1=C(C=CC(=C1)Cl)N2C=NC=N2)C3=CC=CS3

InChI

InChI=1S/C17H16ClN5O2S/c1-11(24)21-14(16-3-2-6-26-16)8-17(25)22-13-7-12(18)4-5-15(13)23-10-19-9-20-23/h2-7,9-10,14H,8H2,1H3,(H,21,24)(H,22,25)