[5-azanyl-3-[(4-piperidin-1-ylsulfonylphenyl)amino]-1,2,4-triazol-1-yl]-thiophen-2-yl-methanone

Systemtic Name: [5-azanyl-3-[(4-piperidin-1-ylsulfonylphenyl)amino]-1,2,4-triazol-1-yl]-thiophen-2-yl-methanone Openeye Name: [5-amino-3-[4-(1-piperidylsulfonyl)anilino]-1,2,4-triazol-1-yl]-(2-thienyl)methanone CAS Name: [5-amino-3-[4-(1-piperidinylsulfonyl)anilino]-1,2,4-triazol-1-yl]-thiophen-2-ylmethanone IUPAC Name: [5-amino-3-(4-piperidin-1-ylsulfonylanilino)-1,2,4-triazol-1-yl]-thiophen-2-ylmethanone Traditional Name: [5-amino-3-(4-piperidinosulfonylanilino)-1,2,4-triazol-1-yl]-(2-thienyl)methanone Formula: C18H20N6O3S2 MolecularWeight: 432.5198

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC3=NN(C(=N3)N)C(=O)C4=CC=CS4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC3=NN(C(=N3)N)C(=O)C4=CC=CS4

InChI

InChI=1S/C18H20N6O3S2/c19-17-21-18(22-24(17)16(25)15-5-4-12-28-15)20-13-6-8-14(9-7-13)29(26,27)23-10-2-1-3-11-23/h4-9,12H,1-3,10-11H2,(H3,19,20,21,22)