N-(4-phenylazanylphenyl)-N-propan-2-yl-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(4-phenylazanylphenyl)-N-propan-2-yl-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: 2-[(4-allyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-anilinophenyl)-N-isopropyl-acetamide CAS Name: N-(4-anilinophenyl)-N-propan-2-yl-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(4-anilinophenyl)-N-propan-2-yl-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: 2-[(4-allyl-1,2,4-triazol-3-yl)thio]-N-(4-anilinophenyl)-N-isopropyl-acetamide Formula: C22H25N5OS MolecularWeight: 407.5318

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=CC=C(C=C1)NC2=CC=CC=C2)C(=O)CSC3=NN=CN3CC=C

Isomeric SMILES

CC(C)N(C1=CC=C(C=C1)NC2=CC=CC=C2)C(=O)CSC3=NN=CN3CC=C

InChI

InChI=1S/C22H25N5OS/c1-4-14-26-16-23-25-22(26)29-15-21(28)27(17(2)3)20-12-10-19(11-13-20)24-18-8-6-5-7-9-18/h4-13,16-17,24H,1,14-15H2,2-3H3