(2S)-2-[(4-cyclopropyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methoxydibenzofuran-3-yl)propanamide

Systemtic Name: (2S)-2-[(4-cyclopropyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methoxydibenzofuran-3-yl)propanamide Openeye Name: (2S)-2-[[4-cyclopropyl-5-(1-piperidyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methoxydibenzofuran-3-yl)propanamide CAS Name: (2S)-2-[[4-cyclopropyl-5-(1-piperidinyl)-1,2,4-triazol-3-yl]thio]-N-(2-methoxy-3-dibenzofuranyl)propanamide IUPAC Name: (2S)-2-[(4-cyclopropyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methoxydibenzofuran-3-yl)propanamide Traditional Name: (2S)-2-[(4-cyclopropyl-5-piperidino-1,2,4-triazol-3-yl)thio]-N-(2-methoxydibenzofuran-3-yl)propionamide Formula: C26H29N5O3S MolecularWeight: 491.60516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C2C3=CC=CC=C3OC2=C1)OC)SC4=NN=C(N4C5CC5)N6CCCCC6

Isomeric SMILES

C[C@@H](C(=O)NC1=C(C=C2C3=CC=CC=C3OC2=C1)OC)SC4=NN=C(N4C5CC5)N6CCCCC6

InChI

InChI=1S/C26H29N5O3S/c1-16(35-26-29-28-25(31(26)17-10-11-17)30-12-6-3-7-13-30)24(32)27-20-15-22-19(14-23(20)33-2)18-8-4-5-9-21(18)34-22/h4-5,8-9,14-17H,3,6-7,10-13H2,1-2H3,(H,27,32)/t16-/m0/s1