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

Systemtic Name: 2-ethoxy-N-[5-(3-imidazol-1-ylpropylamino)-1,3,4-thiadiazol-2-yl]naphthalene-1-carboxamide Openeye Name: 2-ethoxy-N-[5-(3-imidazol-1-ylpropylamino)-1,3,4-thiadiazol-2-yl]naphthalene-1-carboxamide CAS Name: 2-ethoxy-N-[5-[3-(1-imidazolyl)propylamino]-1,3,4-thiadiazol-2-yl]-1-naphthalenecarboxamide IUPAC Name: 2-ethoxy-N-[5-(3-imidazol-1-ylpropylamino)-1,3,4-thiadiazol-2-yl]naphthalene-1-carboxamide Traditional Name: 2-ethoxy-N-[5-(3-imidazol-1-ylpropylamino)-1,3,4-thiadiazol-2-yl]-1-naphthamide Formula: C21H22N6O2S MolecularWeight: 422.50338

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C2=CC=CC=C2C=C1)C(=O)NC3=NN=C(S3)NCCCN4C=CN=C4

Isomeric SMILES

CCOC1=C(C2=CC=CC=C2C=C1)C(=O)NC3=NN=C(S3)NCCCN4C=CN=C4

InChI

InChI=1S/C21H22N6O2S/c1-2-29-17-9-8-15-6-3-4-7-16(15)18(17)19(28)24-21-26-25-20(30-21)23-10-5-12-27-13-11-22-14-27/h3-4,6-9,11,13-14H,2,5,10,12H2,1H3,(H,23,25)(H,24,26,28)