1,2,3-thiadiazol-5-yl 2-[(6-phenylmethoxy-1H-indol-3-yl)methyl]butanoate

Systemtic Name: 1,2,3-thiadiazol-5-yl 2-[(6-phenylmethoxy-1H-indol-3-yl)methyl]butanoate Openeye Name: thiadiazol-5-yl 2-[(6-benzyloxy-1H-indol-3-yl)methyl]butanoate CAS Name: 2-[(6-phenylmethoxy-1H-indol-3-yl)methyl]butanoic acid 5-thiadiazolyl ester IUPAC Name: thiadiazol-5-yl 2-[(6-phenylmethoxy-1H-indol-3-yl)methyl]butanoate Traditional Name: 2-[(6-benzoxy-1H-indol-3-yl)methyl]butyric acid thiadiazol-5-yl ester Formula: C22H21N3O3S MolecularWeight: 407.48544

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CNC2=C1C=CC(=C2)OCC3=CC=CC=C3)C(=O)OC4=CN=NS4

Isomeric SMILES

CCC(CC1=CNC2=C1C=CC(=C2)OCC3=CC=CC=C3)C(=O)OC4=CN=NS4

InChI

InChI=1S/C22H21N3O3S/c1-2-16(22(26)28-21-13-24-25-29-21)10-17-12-23-20-11-18(8-9-19(17)20)27-14-15-6-4-3-5-7-15/h3-9,11-13,16,23H,2,10,14H2,1H3