N-cyclopropyl-4-[[cyclopropyl-[(4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]amino]methyl]benzamide

Systemtic Name: N-cyclopropyl-4-[[cyclopropyl-[(4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]amino]methyl]benzamide Openeye Name: 4-[[(4-allyl-5-thioxo-1,2,4-triazol-1-yl)methyl-cyclopropyl-amino]methyl]-N-cyclopropyl-benzamide CAS Name: N-cyclopropyl-4-[[cyclopropyl-[(4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]amino]methyl]benzamide IUPAC Name: N-cyclopropyl-4-[[cyclopropyl-[(4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]amino]methyl]benzamide Traditional Name: 4-[[(4-allyl-5-thioxo-1,2,4-triazol-1-yl)methyl-cyclopropyl-amino]methyl]-N-cyclopropyl-benzamide Formula: C20H25N5OS MolecularWeight: 383.5104

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C=NN(C1=S)CN(CC2=CC=C(C=C2)C(=O)NC3CC3)C4CC4

Isomeric SMILES

C=CCN1C=NN(C1=S)CN(CC2=CC=C(C=C2)C(=O)NC3CC3)C4CC4

InChI

InChI=1S/C20H25N5OS/c1-2-11-23-13-21-25(20(23)27)14-24(18-9-10-18)12-15-3-5-16(6-4-15)19(26)22-17-7-8-17/h2-6,13,17-18H,1,7-12,14H2,(H,22,26)