ethyl 2-[4-[[5-(3-methylpiperidin-1-yl)-1,3,4-thiadiazol-2-yl]carbamoylamino]phenyl]ethanoate

Systemtic Name: ethyl 2-[4-[[5-(3-methylpiperidin-1-yl)-1,3,4-thiadiazol-2-yl]carbamoylamino]phenyl]ethanoate Openeye Name: ethyl 2-[4-[[5-(3-methyl-1-piperidyl)-1,3,4-thiadiazol-2-yl]carbamoylamino]phenyl]acetate CAS Name: 2-[4-[[[[5-(3-methyl-1-piperidinyl)-1,3,4-thiadiazol-2-yl]amino]-oxomethyl]amino]phenyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[[5-(3-methylpiperidin-1-yl)-1,3,4-thiadiazol-2-yl]carbamoylamino]phenyl]acetate Traditional Name: 2-[4-[[5-(3-methylpiperidino)-1,3,4-thiadiazol-2-yl]carbamoylamino]phenyl]acetic acid ethyl ester Formula: C19H25N5O3S MolecularWeight: 403.4985

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CC=C(C=C1)NC(=O)NC2=NN=C(S2)N3CCCC(C3)C

Isomeric SMILES

CCOC(=O)CC1=CC=C(C=C1)NC(=O)NC2=NN=C(S2)N3CCCC(C3)C

InChI

InChI=1S/C19H25N5O3S/c1-3-27-16(25)11-14-6-8-15(9-7-14)20-17(26)21-18-22-23-19(28-18)24-10-4-5-13(2)12-24/h6-9,13H,3-5,10-12H2,1-2H3,(H2,20,21,22,26)