tert-butyl 2-[(5-azanyl-1,3,4-thiadiazol-2-yl)amino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: tert-butyl 2-[(5-azanyl-1,3,4-thiadiazol-2-yl)amino]-3-(1H-indol-3-yl)propanoate Openeye Name: tert-butyl 2-[(5-amino-1,3,4-thiadiazol-2-yl)amino]-3-(1H-indol-3-yl)propanoate CAS Name: 2-[(5-amino-1,3,4-thiadiazol-2-yl)amino]-3-(1H-indol-3-yl)propanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(5-amino-1,3,4-thiadiazol-2-yl)amino]-3-(1H-indol-3-yl)propanoate Traditional Name: 2-[(5-amino-1,3,4-thiadiazol-2-yl)amino]-3-(1H-indol-3-yl)propionic acid tert-butyl ester Formula: C17H21N5O2S MolecularWeight: 359.44594

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CC1=CNC2=CC=CC=C21)NC3=NN=C(S3)N

Isomeric SMILES

CC(C)(C)OC(=O)C(CC1=CNC2=CC=CC=C21)NC3=NN=C(S3)N

InChI

InChI=1S/C17H21N5O2S/c1-17(2,3)24-14(23)13(20-16-22-21-15(18)25-16)8-10-9-19-12-7-5-4-6-11(10)12/h4-7,9,13,19H,8H2,1-3H3,(H2,18,21)(H,20,22)