1-[(E)-(1-oxidanyl-2,1,3-benzoxadiazol-6-ylidene)methyl]imino-3-propan-2-yl-thiourea

Systemtic Name: 1-[(E)-(1-oxidanyl-2,1,3-benzoxadiazol-6-ylidene)methyl]imino-3-propan-2-yl-thiourea Openeye Name: 1-[(E)-(1-hydroxy-2,1,3-benzoxadiazol-6-ylidene)methyl]imino-3-isopropyl-thiourea CAS Name: 1-[(E)-(1-hydroxy-2,1,3-benzoxadiazol-6-ylidene)methyl]imino-3-propan-2-ylthiourea IUPAC Name: 1-[(E)-(1-hydroxy-2,1,3-benzoxadiazol-6-ylidene)methyl]imino-3-propan-2-ylthiourea Traditional Name: 1-[(E)-(3-hydroxybenzofurazan-5-ylidene)methyl]imino-3-isopropyl-thiourea Formula: C11H13N5O2S MolecularWeight: 279.31822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=S)N=NC=C1C=CC2=NON(C2=C1)O

Isomeric SMILES

CC(C)NC(=S)N=N/C=C/1\C=CC2=NON(C2=C1)O

InChI

InChI=1S/C11H13N5O2S/c1-7(2)13-11(19)14-12-6-8-3-4-9-10(5-8)16(17)18-15-9/h3-7,17H,1-2H3,(H,13,19)/b8-6+,14-12?