1-[3-methyl-1-oxidanylidene-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]butan-2-yl]-3-(phenylmethyl)urea

Systemtic Name: 1-[3-methyl-1-oxidanylidene-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]butan-2-yl]-3-(phenylmethyl)urea Openeye Name: 1-benzyl-3-[2-methyl-1-(4-thiazol-2-ylpiperazine-1-carbonyl)propyl]urea CAS Name: 1-[3-methyl-1-oxo-1-[4-(2-thiazolyl)-1-piperazinyl]butan-2-yl]-3-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-[3-methyl-1-oxo-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]butan-2-yl]urea Traditional Name: 1-benzyl-3-[2-methyl-1-(4-thiazol-2-ylpiperazine-1-carbonyl)propyl]urea Formula: C20H27N5O2S MolecularWeight: 401.52568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCN(CC1)C2=NC=CS2)NC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC(C)C(C(=O)N1CCN(CC1)C2=NC=CS2)NC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C20H27N5O2S/c1-15(2)17(23-19(27)22-14-16-6-4-3-5-7-16)18(26)24-9-11-25(12-10-24)20-21-8-13-28-20/h3-8,13,15,17H,9-12,14H2,1-2H3,(H2,22,23,27)