2-ethoxy-N-[5-(pyridin-3-ylmethylamino)-1,3,4-thiadiazol-2-yl]naphthalene-1-carboxamide

Systemtic Name: 2-ethoxy-N-[5-(pyridin-3-ylmethylamino)-1,3,4-thiadiazol-2-yl]naphthalene-1-carboxamide Openeye Name: 2-ethoxy-N-[5-(3-pyridylmethylamino)-1,3,4-thiadiazol-2-yl]naphthalene-1-carboxamide CAS Name: 2-ethoxy-N-[5-(3-pyridinylmethylamino)-1,3,4-thiadiazol-2-yl]-1-naphthalenecarboxamide IUPAC Name: 2-ethoxy-N-[5-(pyridin-3-ylmethylamino)-1,3,4-thiadiazol-2-yl]naphthalene-1-carboxamide Traditional Name: 2-ethoxy-N-[5-(3-pyridylmethylamino)-1,3,4-thiadiazol-2-yl]-1-naphthamide Formula: C21H19N5O2S MolecularWeight: 405.47286

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C2=CC=CC=C2C=C1)C(=O)NC3=NN=C(S3)NCC4=CN=CC=C4

Isomeric SMILES

CCOC1=C(C2=CC=CC=C2C=C1)C(=O)NC3=NN=C(S3)NCC4=CN=CC=C4

InChI

InChI=1S/C21H19N5O2S/c1-2-28-17-10-9-15-7-3-4-8-16(15)18(17)19(27)24-21-26-25-20(29-21)23-13-14-6-5-11-22-12-14/h3-12H,2,13H2,1H3,(H,23,25)(H,24,26,27)