1-[2-oxidanylidene-1-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)azepan-3-yl]-3-phenyl-thiourea

Systemtic Name: 1-[2-oxidanylidene-1-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)azepan-3-yl]-3-phenyl-thiourea Openeye Name: 1-[2-oxo-1-(2-oxo-2-pyrrolidin-1-yl-ethyl)azepan-3-yl]-3-phenyl-thiourea CAS Name: 1-[2-oxo-1-[2-oxo-2-(1-pyrrolidinyl)ethyl]-3-azepanyl]-3-phenylthiourea IUPAC Name: 1-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]-3-phenylthiourea Traditional Name: 1-[2-keto-1-(2-keto-2-pyrrolidino-ethyl)azepan-3-yl]-3-phenyl-thiourea Formula: C19H26N4O2S MolecularWeight: 374.50034

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(=O)C(C1)NC(=S)NC2=CC=CC=C2)CC(=O)N3CCCC3

Isomeric SMILES

C1CCN(C(=O)C(C1)NC(=S)NC2=CC=CC=C2)CC(=O)N3CCCC3

InChI

InChI=1S/C19H26N4O2S/c24-17(22-11-6-7-12-22)14-23-13-5-4-10-16(18(23)25)21-19(26)20-15-8-2-1-3-9-15/h1-3,8-9,16H,4-7,10-14H2,(H2,20,21,26)