1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-3-(4-ethylphenyl)urea

Systemtic Name: 1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-3-(4-ethylphenyl)urea Openeye Name: 1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-3-(4-ethylphenyl)urea CAS Name: 1-[5-(1-azepanyl)-1,3,4-thiadiazol-2-yl]-3-(4-ethylphenyl)urea IUPAC Name: 1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-3-(4-ethylphenyl)urea Traditional Name: 1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-3-(4-ethylphenyl)urea Formula: C17H23N5OS MolecularWeight: 345.46242

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)NC2=NN=C(S2)N3CCCCCC3

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)NC2=NN=C(S2)N3CCCCCC3

InChI

InChI=1S/C17H23N5OS/c1-2-13-7-9-14(10-8-13)18-15(23)19-16-20-21-17(24-16)22-11-5-3-4-6-12-22/h7-10H,2-6,11-12H2,1H3,(H2,18,19,20,23)