1-[3-chloranyl-4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)phenyl]-3-(2-methoxy-3-methyl-phenyl)carbothioyl-urea

Systemtic Name: 1-[3-chloranyl-4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)phenyl]-3-(2-methoxy-3-methyl-phenyl)carbothioyl-urea Openeye Name: 1-[3-chloro-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]phenyl]-3-(2-methoxy-3-methyl-benzenecarbothioyl)urea CAS Name: 1-[3-chloro-4-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]phenyl]-3-[(2-methoxy-3-methylphenyl)-sulfanylidenemethyl]urea IUPAC Name: 1-[3-chloro-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]phenyl]-3-(2-methoxy-3-methylbenzenecarbothioyl)urea Traditional Name: 1-[3-chloro-4-[4-(2-thenoyl)piperazino]phenyl]-3-(2-methoxy-3-methyl-thiobenzoyl)urea Formula: C25H25ClN4O3S2 MolecularWeight: 529.074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1OC)C(=S)NC(=O)NC2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CS4)Cl

Isomeric SMILES

CC1=CC=CC(=C1OC)C(=S)NC(=O)NC2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CS4)Cl

InChI

InChI=1S/C25H25ClN4O3S2/c1-16-5-3-6-18(22(16)33-2)23(34)28-25(32)27-17-8-9-20(19(26)15-17)29-10-12-30(13-11-29)24(31)21-7-4-14-35-21/h3-9,14-15H,10-13H2,1-2H3,(H2,27,28,32,34)