1-[3-methyl-1-oxidanylidene-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)butan-2-yl]-3-phenyl-urea

Systemtic Name: 1-[3-methyl-1-oxidanylidene-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)butan-2-yl]-3-phenyl-urea Openeye Name: 1-[2-methyl-1-[4-(thiophene-2-carbonyl)piperazine-1-carbonyl]propyl]-3-phenyl-urea CAS Name: 1-[3-methyl-1-oxo-1-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]butan-2-yl]-3-phenylurea IUPAC Name: 1-[3-methyl-1-oxo-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]butan-2-yl]-3-phenylurea Traditional Name: 1-[2-methyl-1-[4-(2-thenoyl)piperazine-1-carbonyl]propyl]-3-phenyl-urea Formula: C21H26N4O3S MolecularWeight: 414.52114

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCN(CC1)C(=O)C2=CC=CS2)NC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC(C)C(C(=O)N1CCN(CC1)C(=O)C2=CC=CS2)NC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H26N4O3S/c1-15(2)18(23-21(28)22-16-7-4-3-5-8-16)20(27)25-12-10-24(11-13-25)19(26)17-9-6-14-29-17/h3-9,14-15,18H,10-13H2,1-2H3,(H2,22,23,28)