N-cyclopropyl-2-[4-[(3-phenyl-4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]ethanamide

Systemtic Name: N-cyclopropyl-2-[4-[(3-phenyl-4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]ethanamide Openeye Name: 2-[4-[(4-allyl-3-phenyl-5-thioxo-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]-N-cyclopropyl-acetamide CAS Name: N-cyclopropyl-2-[4-[(3-phenyl-4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-1-piperazinyl]acetamide IUPAC Name: N-cyclopropyl-2-[4-[(3-phenyl-4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]acetamide Traditional Name: 2-[4-[(4-allyl-3-phenyl-5-thioxo-1,2,4-triazol-1-yl)methyl]piperazino]-N-cyclopropyl-acetamide Formula: C21H28N6OS MolecularWeight: 412.55162

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN(C1=S)CN2CCN(CC2)CC(=O)NC3CC3)C4=CC=CC=C4

Isomeric SMILES

C=CCN1C(=NN(C1=S)CN2CCN(CC2)CC(=O)NC3CC3)C4=CC=CC=C4

InChI

InChI=1S/C21H28N6OS/c1-2-10-26-20(17-6-4-3-5-7-17)23-27(21(26)29)16-25-13-11-24(12-14-25)15-19(28)22-18-8-9-18/h2-7,18H,1,8-16H2,(H,22,28)