1-[(3-chloranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[(3-chloranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[(3-chloro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]thiourea CAS Name: 1-[(3-chloro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-3-prop-2-enylthiourea IUPAC Name: 1-[(3-chloro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[(3-chloro-6-keto-cyclohexa-2,4-dien-1-ylidene)methylamino]thiourea Formula: C11H12ClN3OS MolecularWeight: 269.75048

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)NNC=C1C=C(C=CC1=O)Cl

Isomeric SMILES

C=CCNC(=S)NNC=C1C=C(C=CC1=O)Cl

InChI

InChI=1S/C11H12ClN3OS/c1-2-5-13-11(17)15-14-7-8-6-9(12)3-4-10(8)16/h2-4,6-7,14H,1,5H2,(H2,13,15,17)