1-[3-(dimethylamino)propyl]-3-[1-[(4-ethylphenoxy)methyl]pyrazol-4-yl]thiourea

Systemtic Name: 1-[3-(dimethylamino)propyl]-3-[1-[(4-ethylphenoxy)methyl]pyrazol-4-yl]thiourea Openeye Name: 1-[3-(dimethylamino)propyl]-3-[1-[(4-ethylphenoxy)methyl]pyrazol-4-yl]thiourea CAS Name: 1-[3-(dimethylamino)propyl]-3-[1-[(4-ethylphenoxy)methyl]-4-pyrazolyl]thiourea IUPAC Name: 1-[3-(dimethylamino)propyl]-3-[1-[(4-ethylphenoxy)methyl]pyrazol-4-yl]thiourea Traditional Name: 1-[3-(dimethylamino)propyl]-3-[1-[(4-ethylphenoxy)methyl]pyrazol-4-yl]thiourea Formula: C18H27N5OS MolecularWeight: 361.50488

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCN2C=C(C=N2)NC(=S)NCCCN(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)OCN2C=C(C=N2)NC(=S)NCCCN(C)C

InChI

InChI=1S/C18H27N5OS/c1-4-15-6-8-17(9-7-15)24-14-23-13-16(12-20-23)21-18(25)19-10-5-11-22(2)3/h6-9,12-13H,4-5,10-11,14H2,1-3H3,(H2,19,21,25)