1-[[2-chloranyl-5-(4-phenylpiperazin-1-yl)sulfonyl-phenyl]carbonylamino]-3-ethyl-thiourea

Systemtic Name: 1-[[2-chloranyl-5-(4-phenylpiperazin-1-yl)sulfonyl-phenyl]carbonylamino]-3-ethyl-thiourea Openeye Name: 1-[[2-chloro-5-(4-phenylpiperazin-1-yl)sulfonyl-benzoyl]amino]-3-ethyl-thiourea CAS Name: 1-[[[2-chloro-5-[(4-phenyl-1-piperazinyl)sulfonyl]phenyl]-oxomethyl]amino]-3-ethylthiourea IUPAC Name: 1-[[2-chloro-5-(4-phenylpiperazin-1-yl)sulfonylbenzoyl]amino]-3-ethylthiourea Traditional Name: 1-[[2-chloro-5-(4-phenylpiperazino)sulfonyl-benzoyl]amino]-3-ethyl-thiourea Formula: C20H24ClN5O3S2 MolecularWeight: 482.01926

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NNC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCN(CC2)C3=CC=CC=C3)Cl

Isomeric SMILES

CCNC(=S)NNC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCN(CC2)C3=CC=CC=C3)Cl

InChI

InChI=1S/C20H24ClN5O3S2/c1-2-22-20(30)24-23-19(27)17-14-16(8-9-18(17)21)31(28,29)26-12-10-25(11-13-26)15-6-4-3-5-7-15/h3-9,14H,2,10-13H2,1H3,(H,23,27)(H2,22,24,30)