N-(2-nitrophenyl)-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: N-(2-nitrophenyl)-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: 2-[(4-allyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-nitrophenyl)propanamide CAS Name: N-(2-nitrophenyl)-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-(2-nitrophenyl)-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: 2-[(4-allyl-1,2,4-triazol-3-yl)thio]-N-(2-nitrophenyl)propionamide Formula: C14H15N5O3S MolecularWeight: 333.3656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1[N+](=O)[O-])SC2=NN=CN2CC=C

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1[N+](=O)[O-])SC2=NN=CN2CC=C

InChI

InChI=1S/C14H15N5O3S/c1-3-8-18-9-15-17-14(18)23-10(2)13(20)16-11-6-4-5-7-12(11)19(21)22/h3-7,9-10H,1,8H2,2H3,(H,16,20)