1-[(Z)-1-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)ethylideneamino]-3-pentyl-thiourea

Systemtic Name: 1-[(Z)-1-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)ethylideneamino]-3-pentyl-thiourea Openeye Name: 1-[(Z)-1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethylideneamino]-3-pentyl-thiourea CAS Name: 1-[(Z)-1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethylideneamino]-3-pentylthiourea IUPAC Name: 1-[(Z)-1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethylideneamino]-3-pentylthiourea Traditional Name: 1-amyl-3-[(Z)-1-(3-keto-4H-1,4-benzoxazin-6-yl)ethylideneamino]thiourea Formula: C16H22N4O2S MolecularWeight: 334.43648

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=S)NN=C(C)C1=CC2=C(C=C1)OCC(=O)N2

Isomeric SMILES

CCCCCNC(=S)N/N=C(/C)\C1=CC2=C(C=C1)OCC(=O)N2

InChI

InChI=1S/C16H22N4O2S/c1-3-4-5-8-17-16(23)20-19-11(2)12-6-7-14-13(9-12)18-15(21)10-22-14/h6-7,9H,3-5,8,10H2,1-2H3,(H,18,21)(H2,17,20,23)/b19-11-