3-[3-[2-(cyclooctylamino)-2-oxidanylidene-ethyl]sulfanyl-5-cyclopropyl-1,2,4-triazol-4-yl]propanamide

Systemtic Name: 3-[3-[2-(cyclooctylamino)-2-oxidanylidene-ethyl]sulfanyl-5-cyclopropyl-1,2,4-triazol-4-yl]propanamide Openeye Name: 3-[3-[2-(cyclooctylamino)-2-oxo-ethyl]sulfanyl-5-cyclopropyl-1,2,4-triazol-4-yl]propanamide CAS Name: 3-[3-[[2-(cyclooctylamino)-2-oxoethyl]thio]-5-cyclopropyl-1,2,4-triazol-4-yl]propanamide IUPAC Name: 3-[3-[2-(cyclooctylamino)-2-oxoethyl]sulfanyl-5-cyclopropyl-1,2,4-triazol-4-yl]propanamide Traditional Name: 3-[3-[[2-(cyclooctylamino)-2-keto-ethyl]thio]-5-cyclopropyl-1,2,4-triazol-4-yl]propionamide Formula: C18H29N5O2S MolecularWeight: 379.52016

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=O)CSC2=NN=C(N2CCC(=O)N)C3CC3

Isomeric SMILES

C1CCCC(CCC1)NC(=O)CSC2=NN=C(N2CCC(=O)N)C3CC3

InChI

InChI=1S/C18H29N5O2S/c19-15(24)10-11-23-17(13-8-9-13)21-22-18(23)26-12-16(25)20-14-6-4-2-1-3-5-7-14/h13-14H,1-12H2,(H2,19,24)(H,20,25)