1-[5-tert-butyl-3-[(5-oxidanylidene-1,4-diazepan-1-yl)carbonyl]thiophen-2-yl]-3-naphthalen-2-yl-urea

Systemtic Name: 1-[5-tert-butyl-3-[(5-oxidanylidene-1,4-diazepan-1-yl)carbonyl]thiophen-2-yl]-3-naphthalen-2-yl-urea Openeye Name: 1-[5-tert-butyl-3-(5-oxo-1,4-diazepane-1-carbonyl)-2-thienyl]-3-(2-naphthyl)urea CAS Name: 1-[5-tert-butyl-3-[oxo-(5-oxo-1,4-diazepan-1-yl)methyl]-2-thiophenyl]-3-(2-naphthalenyl)urea IUPAC Name: 1-[5-tert-butyl-3-(5-oxo-1,4-diazepane-1-carbonyl)thiophen-2-yl]-3-naphthalen-2-ylurea Traditional Name: 1-[5-tert-butyl-3-(5-keto-1,4-diazepane-1-carbonyl)-2-thienyl]-3-(2-naphthyl)urea Formula: C25H28N4O3S MolecularWeight: 464.57982

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(S1)NC(=O)NC2=CC3=CC=CC=C3C=C2)C(=O)N4CCC(=O)NCC4

Isomeric SMILES

CC(C)(C)C1=CC(=C(S1)NC(=O)NC2=CC3=CC=CC=C3C=C2)C(=O)N4CCC(=O)NCC4

InChI

InChI=1S/C25H28N4O3S/c1-25(2,3)20-15-19(23(31)29-12-10-21(30)26-11-13-29)22(33-20)28-24(32)27-18-9-8-16-6-4-5-7-17(16)14-18/h4-9,14-15H,10-13H2,1-3H3,(H,26,30)(H2,27,28,32)