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

Systemtic Name: N-[2-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]-4-methoxy-benzamide Openeye Name: N-[2-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-4-methoxy-benzamide CAS Name: N-[2-[[4-cyclopropyl-5-(1-pyrrolidinyl)-1,2,4-triazol-3-yl]thio]-1-oxoethyl]-4-methoxybenzamide IUPAC Name: N-[2-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-4-methoxybenzamide Traditional Name: N-[2-[(4-cyclopropyl-5-pyrrolidino-1,2,4-triazol-3-yl)thio]acetyl]-4-methoxy-benzamide Formula: C19H23N5O3S MolecularWeight: 401.48262

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC(=O)CSC2=NN=C(N2C3CC3)N4CCCC4

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC(=O)CSC2=NN=C(N2C3CC3)N4CCCC4

InChI

InChI=1S/C19H23N5O3S/c1-27-15-8-4-13(5-9-15)17(26)20-16(25)12-28-19-22-21-18(23-10-2-3-11-23)24(19)14-6-7-14/h4-5,8-9,14H,2-3,6-7,10-12H2,1H3,(H,20,25,26)