N-cyclopentyl-2-[2-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]benzamide

Systemtic Name: N-cyclopentyl-2-[2-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]benzamide Openeye Name: N-cyclopentyl-2-[[2-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzamide CAS Name: N-cyclopentyl-2-[[2-[[4-cyclopropyl-5-(1-pyrrolidinyl)-1,2,4-triazol-3-yl]thio]-1-oxoethyl]amino]benzamide IUPAC Name: N-cyclopentyl-2-[[2-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzamide Traditional Name: N-cyclopentyl-2-[[2-[(4-cyclopropyl-5-pyrrolidino-1,2,4-triazol-3-yl)thio]acetyl]amino]benzamide Formula: C23H30N6O2S MolecularWeight: 454.5883

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)C2=CC=CC=C2NC(=O)CSC3=NN=C(N3C4CC4)N5CCCC5

Isomeric SMILES

C1CCC(C1)NC(=O)C2=CC=CC=C2NC(=O)CSC3=NN=C(N3C4CC4)N5CCCC5

InChI

InChI=1S/C23H30N6O2S/c30-20(25-19-10-4-3-9-18(19)21(31)24-16-7-1-2-8-16)15-32-23-27-26-22(28-13-5-6-14-28)29(23)17-11-12-17/h3-4,9-10,16-17H,1-2,5-8,11-15H2,(H,24,31)(H,25,30)