[5-[(phenylmethyl)amino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]-thiophen-2-yl-methanone

Systemtic Name: [5-[(phenylmethyl)amino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]-thiophen-2-yl-methanone Openeye Name: [5-(benzylamino)-3-(3-pyridyl)-1,2,4-triazol-1-yl]-(2-thienyl)methanone CAS Name: [5-[(phenylmethyl)amino]-3-(3-pyridinyl)-1,2,4-triazol-1-yl]-thiophen-2-ylmethanone IUPAC Name: [5-(benzylamino)-3-pyridin-3-yl-1,2,4-triazol-1-yl]-thiophen-2-ylmethanone Traditional Name: [5-(benzylamino)-3-(3-pyridyl)-1,2,4-triazol-1-yl]-(2-thienyl)methanone Formula: C19H15N5OS MolecularWeight: 361.4203

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC(=NN2C(=O)C3=CC=CS3)C4=CN=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC(=NN2C(=O)C3=CC=CS3)C4=CN=CC=C4

InChI

InChI=1S/C19H15N5OS/c25-18(16-9-5-11-26-16)24-19(21-12-14-6-2-1-3-7-14)22-17(23-24)15-8-4-10-20-13-15/h1-11,13H,12H2,(H,21,22,23)