1-[4-[3-(azepan-1-yl)-3-oxidanylidene-propyl]-1,3-thiazol-2-yl]-3-(4-methoxyphenyl)urea

Systemtic Name: 1-[4-[3-(azepan-1-yl)-3-oxidanylidene-propyl]-1,3-thiazol-2-yl]-3-(4-methoxyphenyl)urea Openeye Name: 1-[4-[3-(azepan-1-yl)-3-oxo-propyl]thiazol-2-yl]-3-(4-methoxyphenyl)urea CAS Name: 1-[4-[3-(1-azepanyl)-3-oxopropyl]-2-thiazolyl]-3-(4-methoxyphenyl)urea IUPAC Name: 1-[4-[3-(azepan-1-yl)-3-oxopropyl]-1,3-thiazol-2-yl]-3-(4-methoxyphenyl)urea Traditional Name: 1-[4-[3-(azepan-1-yl)-3-keto-propyl]thiazol-2-yl]-3-(4-methoxyphenyl)urea Formula: C20H26N4O3S MolecularWeight: 402.51044

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)NC2=NC(=CS2)CCC(=O)N3CCCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)NC2=NC(=CS2)CCC(=O)N3CCCCCC3

InChI

InChI=1S/C20H26N4O3S/c1-27-17-9-6-15(7-10-17)21-19(26)23-20-22-16(14-28-20)8-11-18(25)24-12-4-2-3-5-13-24/h6-7,9-10,14H,2-5,8,11-13H2,1H3,(H2,21,22,23,26)