1-[2-(4-oxidanylidene-2,3-dihydro-1,5-benzoxazepin-5-yl)ethanoylamino]-3-pentyl-thiourea

Systemtic Name: 1-[2-(4-oxidanylidene-2,3-dihydro-1,5-benzoxazepin-5-yl)ethanoylamino]-3-pentyl-thiourea Openeye Name: 1-[[2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)acetyl]amino]-3-pentyl-thiourea CAS Name: 1-[[1-oxo-2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)ethyl]amino]-3-pentylthiourea IUPAC Name: 1-[[2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)acetyl]amino]-3-pentylthiourea Traditional Name: 1-amyl-3-[[2-(4-keto-2,3-dihydro-1,5-benzoxazepin-5-yl)acetyl]amino]thiourea Formula: C17H24N4O3S MolecularWeight: 364.46246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=S)NNC(=O)CN1C(=O)CCOC2=CC=CC=C21

Isomeric SMILES

CCCCCNC(=S)NNC(=O)CN1C(=O)CCOC2=CC=CC=C21

InChI

InChI=1S/C17H24N4O3S/c1-2-3-6-10-18-17(25)20-19-15(22)12-21-13-7-4-5-8-14(13)24-11-9-16(21)23/h4-5,7-8H,2-3,6,9-12H2,1H3,(H,19,22)(H2,18,20,25)