ethyl 2-[(5-pyrrolidin-1-yl-1,3,4-thiadiazol-2-yl)carbamoylamino]benzoate

Systemtic Name: ethyl 2-[(5-pyrrolidin-1-yl-1,3,4-thiadiazol-2-yl)carbamoylamino]benzoate Openeye Name: ethyl 2-[(5-pyrrolidin-1-yl-1,3,4-thiadiazol-2-yl)carbamoylamino]benzoate CAS Name: 2-[[oxo-[[5-(1-pyrrolidinyl)-1,3,4-thiadiazol-2-yl]amino]methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[(5-pyrrolidin-1-yl-1,3,4-thiadiazol-2-yl)carbamoylamino]benzoate Traditional Name: 2-[(5-pyrrolidino-1,3,4-thiadiazol-2-yl)carbamoylamino]benzoic acid ethyl ester Formula: C16H19N5O3S MolecularWeight: 361.41876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=O)NC2=NN=C(S2)N3CCCC3

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=O)NC2=NN=C(S2)N3CCCC3

InChI

InChI=1S/C16H19N5O3S/c1-2-24-13(22)11-7-3-4-8-12(11)17-14(23)18-15-19-20-16(25-15)21-9-5-6-10-21/h3-4,7-8H,2,5-6,9-10H2,1H3,(H2,17,18,19,23)