1-tert-butyl-3-[[(E)-3-(3-chloranyl-1-benzothiophen-2-yl)prop-2-enoyl]amino]thiourea

Systemtic Name: 1-tert-butyl-3-[[(E)-3-(3-chloranyl-1-benzothiophen-2-yl)prop-2-enoyl]amino]thiourea Openeye Name: 1-tert-butyl-3-[[(E)-3-(3-chlorobenzothiophen-2-yl)prop-2-enoyl]amino]thiourea CAS Name: 1-tert-butyl-3-[[(E)-3-(3-chloro-1-benzothiophen-2-yl)-1-oxoprop-2-enyl]amino]thiourea IUPAC Name: 1-tert-butyl-3-[[(E)-3-(3-chloro-1-benzothiophen-2-yl)prop-2-enoyl]amino]thiourea Traditional Name: 1-tert-butyl-3-[[(E)-3-(3-chlorobenzothiophen-2-yl)acryloyl]amino]thiourea Formula: C16H18ClN3OS2 MolecularWeight: 367.91662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)NNC(=O)C=CC1=C(C2=CC=CC=C2S1)Cl

Isomeric SMILES

CC(C)(C)NC(=S)NNC(=O)/C=C/C1=C(C2=CC=CC=C2S1)Cl

InChI

InChI=1S/C16H18ClN3OS2/c1-16(2,3)18-15(22)20-19-13(21)9-8-12-14(17)10-6-4-5-7-11(10)23-12/h4-9H,1-3H3,(H,19,21)(H2,18,20,22)/b9-8+