1-[3-[(4-tert-butylphenyl)methoxy]thiophen-2-yl]-3-[3-(dimethylamino)propyl]urea

Systemtic Name: 1-[3-[(4-tert-butylphenyl)methoxy]thiophen-2-yl]-3-[3-(dimethylamino)propyl]urea Openeye Name: 1-[3-[(4-tert-butylphenyl)methoxy]-2-thienyl]-3-[3-(dimethylamino)propyl]urea CAS Name: 1-[3-[(4-tert-butylphenyl)methoxy]-2-thiophenyl]-3-[3-(dimethylamino)propyl]urea IUPAC Name: 1-[3-[(4-tert-butylphenyl)methoxy]thiophen-2-yl]-3-[3-(dimethylamino)propyl]urea Traditional Name: 1-[3-(4-tert-butylbenzyl)oxy-2-thienyl]-3-[3-(dimethylamino)propyl]urea Formula: C21H31N3O2S MolecularWeight: 389.55474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)COC2=C(SC=C2)NC(=O)NCCCN(C)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)COC2=C(SC=C2)NC(=O)NCCCN(C)C

InChI

InChI=1S/C21H31N3O2S/c1-21(2,3)17-9-7-16(8-10-17)15-26-18-11-14-27-19(18)23-20(25)22-12-6-13-24(4)5/h7-11,14H,6,12-13,15H2,1-5H3,(H2,22,23,25)