1-[[4-(azepan-1-ylsulfonyl)phenyl]carbonylamino]-3-cyclopentyl-thiourea

Systemtic Name: 1-[[4-(azepan-1-ylsulfonyl)phenyl]carbonylamino]-3-cyclopentyl-thiourea Openeye Name: 1-[[4-(azepan-1-ylsulfonyl)benzoyl]amino]-3-cyclopentyl-thiourea CAS Name: 1-[[[4-(1-azepanylsulfonyl)phenyl]-oxomethyl]amino]-3-cyclopentylthiourea IUPAC Name: 1-[[4-(azepan-1-ylsulfonyl)benzoyl]amino]-3-cyclopentylthiourea Traditional Name: 1-[[4-(azepan-1-ylsulfonyl)benzoyl]amino]-3-cyclopentyl-thiourea Formula: C19H28N4O3S2 MolecularWeight: 424.58062

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NNC(=S)NC3CCCC3

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NNC(=S)NC3CCCC3

InChI

InChI=1S/C19H28N4O3S2/c24-18(21-22-19(27)20-16-7-3-4-8-16)15-9-11-17(12-10-15)28(25,26)23-13-5-1-2-6-14-23/h9-12,16H,1-8,13-14H2,(H,21,24)(H2,20,22,27)