1-[[3-(4-ethanoylpiperazin-1-yl)sulfonylphenyl]carbonylamino]-3-ethyl-thiourea

Systemtic Name: 1-[[3-(4-ethanoylpiperazin-1-yl)sulfonylphenyl]carbonylamino]-3-ethyl-thiourea Openeye Name: 1-[[3-(4-acetylpiperazin-1-yl)sulfonylbenzoyl]amino]-3-ethyl-thiourea CAS Name: 1-[[[3-[(4-acetyl-1-piperazinyl)sulfonyl]phenyl]-oxomethyl]amino]-3-ethylthiourea IUPAC Name: 1-[[3-(4-acetylpiperazin-1-yl)sulfonylbenzoyl]amino]-3-ethylthiourea Traditional Name: 1-[[3-(4-acetylpiperazino)sulfonylbenzoyl]amino]-3-ethyl-thiourea Formula: C16H23N5O4S2 MolecularWeight: 413.51492

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N5O4S2/c1-3-17-16(26)19-18-15(23)13-5-4-6-14(11-13)27(24,25)21-9-7-20(8-10-21)12(2)22/h4-6,11H,3,7-10H2,1-2H3,(H,18,23)(H2,17,19,26)