[4-[(3-methyl-4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]-thiophen-2-yl-methanone

Systemtic Name: [4-[(3-methyl-4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]-thiophen-2-yl-methanone Openeye Name: [4-[(4-allyl-3-methyl-5-thioxo-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]-(2-thienyl)methanone CAS Name: [4-[(3-methyl-4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-1-piperazinyl]-thiophen-2-ylmethanone IUPAC Name: [4-[(3-methyl-4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]-thiophen-2-ylmethanone Traditional Name: [4-[(4-allyl-3-methyl-5-thioxo-1,2,4-triazol-1-yl)methyl]piperazino]-(2-thienyl)methanone Formula: C16H21N5OS2 MolecularWeight: 363.50084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=S)N1CC=C)CN2CCN(CC2)C(=O)C3=CC=CS3

Isomeric SMILES

CC1=NN(C(=S)N1CC=C)CN2CCN(CC2)C(=O)C3=CC=CS3

InChI

InChI=1S/C16H21N5OS2/c1-3-6-20-13(2)17-21(16(20)23)12-18-7-9-19(10-8-18)15(22)14-5-4-11-24-14/h3-5,11H,1,6-10,12H2,2H3