1-[(E)-(2-methyl-1,3-dioxan-4-yl)methylideneamino]-3-phenyl-thiourea

Systemtic Name: 1-[(E)-(2-methyl-1,3-dioxan-4-yl)methylideneamino]-3-phenyl-thiourea Openeye Name: 1-[(E)-(2-methyl-1,3-dioxan-4-yl)methyleneamino]-3-phenyl-thiourea CAS Name: 1-[(E)-(2-methyl-1,3-dioxan-4-yl)methylideneamino]-3-phenylthiourea IUPAC Name: 1-[(E)-(2-methyl-1,3-dioxan-4-yl)methylideneamino]-3-phenylthiourea Traditional Name: 1-[(E)-(2-methyl-1,3-dioxan-4-yl)methyleneamino]-3-phenyl-thiourea Formula: C13H17N3O2S MolecularWeight: 279.35798

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Descriptors Computed from Structure

Canonical SMILES:

CC1OCCC(O1)C=NNC(=S)NC2=CC=CC=C2

Isomeric SMILES

CC1OCCC(O1)/C=N/NC(=S)NC2=CC=CC=C2

InChI

InChI=1S/C13H17N3O2S/c1-10-17-8-7-12(18-10)9-14-16-13(19)15-11-5-3-2-4-6-11/h2-6,9-10,12H,7-8H2,1H3,(H2,15,16,19)/b14-9+