3-chloranyl-N-methyl-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-methyl-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-methyl-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-methyl-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-methyl-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-methyl-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzothiophene-2-carboxamide Formula: C20H17ClN4OS MolecularWeight: 396.89318

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2C=NC=N2)N(C)C(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

CC(C1=CC=C(C=C1)N2C=NC=N2)N(C)C(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C20H17ClN4OS/c1-13(14-7-9-15(10-8-14)25-12-22-11-23-25)24(2)20(26)19-18(21)16-5-3-4-6-17(16)27-19/h3-13H,1-2H3