1-[[4-[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-yl]carbonylphenyl]methyl]-3-propan-2-yl-urea

Systemtic Name: 1-[[4-[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-yl]carbonylphenyl]methyl]-3-propan-2-yl-urea Openeye Name: 1-[[4-[4-[(5-chloro-2-thienyl)methyl]piperazine-1-carbonyl]phenyl]methyl]-3-isopropyl-urea CAS Name: 1-[[4-[[4-[(5-chloro-2-thiophenyl)methyl]-1-piperazinyl]-oxomethyl]phenyl]methyl]-3-propan-2-ylurea IUPAC Name: 1-[[4-[4-[(5-chlorothiophen-2-yl)methyl]piperazine-1-carbonyl]phenyl]methyl]-3-propan-2-ylurea Traditional Name: 1-[4-[4-[(5-chloro-2-thienyl)methyl]piperazine-1-carbonyl]benzyl]-3-isopropyl-urea Formula: C21H27ClN4O2S MolecularWeight: 434.98268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)N2CCN(CC2)CC3=CC=C(S3)Cl

Isomeric SMILES

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)N2CCN(CC2)CC3=CC=C(S3)Cl

InChI

InChI=1S/C21H27ClN4O2S/c1-15(2)24-21(28)23-13-16-3-5-17(6-4-16)20(27)26-11-9-25(10-12-26)14-18-7-8-19(22)29-18/h3-8,15H,9-14H2,1-2H3,(H2,23,24,28)