1-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]-3-(4-phenoxyphenyl)thiourea

Systemtic Name: 1-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]-3-(4-phenoxyphenyl)thiourea Openeye Name: 1-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]-3-(4-phenoxyphenyl)thiourea CAS Name: 1-[4-(4-ethyl-1-piperazinyl)-2-methylphenyl]-3-(4-phenoxyphenyl)thiourea IUPAC Name: 1-[4-(4-ethylpiperazin-1-yl)-2-methylphenyl]-3-(4-phenoxyphenyl)thiourea Traditional Name: 1-[4-(4-ethylpiperazino)-2-methyl-phenyl]-3-(4-phenoxyphenyl)thiourea Formula: C26H30N4OS MolecularWeight: 446.6076

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC(=C(C=C2)NC(=S)NC3=CC=C(C=C3)OC4=CC=CC=C4)C

Isomeric SMILES

CCN1CCN(CC1)C2=CC(=C(C=C2)NC(=S)NC3=CC=C(C=C3)OC4=CC=CC=C4)C

InChI

InChI=1S/C26H30N4OS/c1-3-29-15-17-30(18-16-29)22-11-14-25(20(2)19-22)28-26(32)27-21-9-12-24(13-10-21)31-23-7-5-4-6-8-23/h4-14,19H,3,15-18H2,1-2H3,(H2,27,28,32)